SCHEMBL16823076

SCHEMBL16823076

c1cc2cnc(Nc3ccc(N4CCNCC4)cc3)nc2c(-c2ccc(OCCN3CCOCC3)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 4/20 0.51
▸ KDR P35968 1/20 0.51
▸ KCNH2 Q12809 2/20 0.48
▸ MYLK4 Q86YV6 1/20 0.48
▸ STK17A Q9UEE5 1/20 0.48
▸ CDK2 P24941 5/20 0.47
▸ CCNA2 P20248 2/20 0.47
▸ TTK P33981 2/20 0.47
▸ EGFR P00533 3/20 0.46
▸ CDK4 P11802 3/20 0.46
▸ CCNB1 P14635 3/20 0.46
▸ CCND1 P24385 3/20 0.46
▸ CCNE1 P24864 3/20 0.46
▸ BRAF P15056 1/20 0.46
▸ SRC P12931 1/20 0.45
▸ LRRK2 Q5S007 2/20 0.45
▸ BACE1 P56817 1/20 0.44
▸ AURKA O14965 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ JAK2 O60674 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29848140 1.00 CDK1 (0.51) CDK1KDRKCNH2MYLK4STK17A
SCHEMBL16823034 0.94 CDK1 (0.54) CDK1KDRCDK2CCNA2TTK
SCHEMBL29847977 0.94 CDK1 (0.54) CDK1KDRCDK2CCNA2TTK
SCHEMBL29847765 0.91 KDR (0.47) CDK1KDRKCNH2MYLK4STK17A
SCHEMBL16513754 0.91 KDR (0.47) CDK1KDRKCNH2MYLK4STK17A
SCHEMBL16822855 0.91 MYLK4 (0.46) CDK1KCNH2MYLK4STK17ACDK2
SCHEMBL29847814 0.91 MYLK4 (0.46) CDK1KCNH2MYLK4STK17ACDK2
SCHEMBL16514975 0.88 LRRK2 (0.45) CDK1KDRKCNH2MYLK4STK17A
SCHEMBL16513959 0.88 LRRK2 (0.45) CDK1KDRKCNH2MYLK4STK17A
SCHEMBL29848365 0.88 LRRK2 (0.45) CDK1KDRKCNH2MYLK4STK17A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC (US) 2025-09-02 — — US claimed
US-20240197752-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA INC 2024-06-20 — — US claimed
US-20170050936-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC. 2017-02-23 — — US claimed
US-20150175601-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC. 2015-06-25 — — US claimed
US-20260102406-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA INC (US) 2026-04-16 — — US disclosed
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC (US) 2025-09-02 — — US disclosed
US-20240197752-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA INC 2024-06-20 — — US disclosed
US-11865120-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2024-01-09 — — US disclosed
US-20220354864-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA, INC. 2022-11-10 — — US disclosed
US-11304957-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2022-04-19 — — US disclosed
US-20200306259-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA, INC. 2020-10-01 — — US disclosed
US-10653701-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2020-05-19 — — US disclosed
US-10172868-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2019-01-08 — — US disclosed
US-20180125855-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA, INC. 2018-05-10 — — US disclosed
US-9849139-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2017-12-26 — — US disclosed
US-20170196881-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA, INC. 2017-07-13 — — US disclosed
US-20170050936-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC. 2017-02-23 — — US disclosed
US-9550770-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2017-01-24 — — US disclosed
US-20150175601-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC. 2015-06-25 — — US disclosed
US-20110313019-A1 OLIGOMERIC COMPOUNDS AND METHODS ISIS PHARMACEUTICALS, INC. (US) 2011-12-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10172868-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20170196881-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20240197752-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-11865120-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20150175601-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS BRAF, PIK3CA, PLK1 CDK1 61/4885KDR 1405/4885KCNH2 2164/4885
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20180125855-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20110313019-A1 OLIGOMERIC COMPOUNDS AND METHODS HNRNPH1, RNASEH1, HNRNPH3 CDK1 2894/4885KDR 4732/4885KCNH2 3049/4885
US-10653701-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-11304957-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20200306259-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20220354864-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 CDK1 100/4885KDR 950/4885KCNH2 2806/4885
US-20170050936-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CDK2, MAP3K6, MAP3K2 CDK1 56/4885KDR 720/4885KCNH2 3770/4885
US-20260102406-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY BRAF, TTK, MAP4K2 CDK1 331/4885KDR 627/4885KCNH2 1236/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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