SCHEMBL21698783

SCHEMBL21698783

CC1CC(=O)c2c(ncn2C(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.37
▸ GRM5 P41594 6/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ CSNK2A3 Q8NEV1 1/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ CYP11B2 P19099 3/20 0.35
▸ RAB9A P51151 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAOB P27338 2/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CB P42338 1/20 0.31

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
SCHEMBL21670417 0.73 CYP11B2 (0.48) CYP11B2
SCHEMBL24328697 0.70 TP53 (0.31) —
SCHEMBL24328037 0.70 CYP11B2 (0.50) CSNK2A2CSNK2BCSNK2A1ABCG2CYP11B2
SCHEMBL24683711 0.67 — —
SCHEMBL26377790 0.66 CSNK2A2 (0.35) CSNK2A2CSNK2BCSNK2A1CSNK2A3ABCG2
SCHEMBL26380716 0.66 CSNK2A2 (0.35) CSNK2A2CSNK2BCSNK2A1CSNK2A3ABCG2
SCHEMBL24329230 0.63 MAPK14 (0.36) SMN1; SMN2KDM4EPIK3CAHTT
SCHEMBL18762232 0.61 ADORA2A (0.32) —
SCHEMBL21670416 0.60 KDM4E (0.31) KDM4EKMT2A
SCHEMBL21670414 0.60 KDM4E (0.31) KDM4EKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312583-A1 1H-IMIDAZO [4,5-H] QUINAZOLINE COMPOUND AS NOVEL SELECTIVE FLT3 INHIBITORS SHENGKE PHARMACEUTICALS (JIANGSU) LTD. (CN) 2023-10-05 — — US disclosed
US-20230312583-A1 1H-IMIDAZO [4,5-H] QUINAZOLINE COMPOUND AS NOVEL SELECTIVE FLT3 INHIBITORS SHENGKE PHARMACEUTICALS (JIANGSU) LTD. (CN) 2023-10-05 — — US disclosed
WO-2022042676-A1 1H-IMIDAZO [4,5-H] QUINAZOLINE COMPOUND AS NOVEL SELECTIVE FLT3 INHIBITORS SHENGKE PHARMACEUTICALS (JIANGSU) LTD. (CN) 2022-03-03 — — WO disclosed
EP-3608321-A1 1H-IMIDAZO[4,5-H]QUINAZOLINE COMPOUND AS PROTEIN KINASE INHIBITOR Shengke Pharmaceuticals (Jiangsu) Ltd. (CN) 2020-02-12 — — EP 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 (1 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-20230312583-A1 1H-IMIDAZO [4,5-H] QUINAZOLINE COMPOUND AS NOVEL SELECTIVE FLT3 INHIBITORS FLT3, ABL1, FLI1 POLB 2869/4885GRM5 2324/4885CSNK2A2 746/4885

“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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