SCHEMBL12017954

SCHEMBL12017954

CS(=O)(=O)Nc1ccc(F)cn1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.48
▸ MAPK10 P53779 1/20 0.47
▸ BRD4 O60885 1/20 0.47
▸ SLC22A12 Q96S37 9/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ SCN9A Q15858 1/20 0.42
▸ AURKA O14965 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ CCNB1 P14635 1/20 0.41
▸ PIK3CG P48736 1/20 0.41

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
SCHEMBL30011424 1.00 ABL1 (0.48) ABL1MAPK10BRD4SLC22A12PTGS1
SCHEMBL14599975 0.84 BRD4 (0.43) MAPK10BRD4SLC22A12
SCHEMBL31011117 0.81 KDM4E (0.50) MAPK10BRD4SLC22A12
SCHEMBL12508238 0.78 KDM4E (0.58) PIK3CG
SCHEMBL31011093 0.78 KDM4E (0.57) ABL1BRD4SLC22A12
SCHEMBL1973088 0.77 DEGS1 (0.46) PIK3CG
SCHEMBL7351894 0.77 CA12 (0.46) PTGS1PIK3CG
SCHEMBL12018120 0.77 KDM4E (0.60) —
SCHEMBL12266080 0.77 ALDH1A1 (0.54) BRD4SLC22A12PTGS1PTGS2
SCHEMBL12094975 0.77 PIK3CG (0.41) ABL1AURKACDK1CCNB1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113490668-B Compounds and compositions for the treatment of diseases associated with APJ receptor activity 安娜普尔纳生物股份有限公司 2025-02-25 — — CN disclosed
US-20240269137-A1 HDAC6 INHIBITORS FOR TREATMENT OF DILATED CARDIOMYOPATHY TENAYA THERAPEUTICS, INC. 2024-08-15 — — US disclosed
US-20230348441-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR MEDSHINE DISCOVERY INC. (CN) 2023-11-02 — — US disclosed
CN-113490668-A Compounds and compositions for treating diseases associated with APJ receptor activity 安娜普尔纳生物股份有限公司 2021-10-08 — — CN disclosed
WO-2021047674-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR 南京明德新药研发有限公司 2021-03-18 — — WO disclosed
US-8530486-B2 Quinazolines and related heterocyclic compounds, and their therapeutic use VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2013-09-10 — — US disclosed
US-8530486-B2 Quinazolines and related heterocyclic compounds, and their therapeutic use VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2013-09-10 — — US disclosed
US-8263585-B2 Organic compounds NOVARTIS AG (CH) 2012-09-11 — — US disclosed
US-8263585-B2 Organic compounds NOVARTIS AG (CH) 2012-09-11 — — US disclosed
EP-2173722-B1 PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2012-08-29 — — EP disclosed
US-20100298322-A1 Quinazolines and Related Heterocyclic Compounds, and Their Therapeutic Use VERENIGING VOOR CHRISTELIJK, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2010-11-25 — — US disclosed
WO-2009083608-A1 QUINAZOLINES AND RELATED HETEROCYCLIC COMPOUNDS, AND THEIR THERAPEUTIC USE VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) 2009-07-09 — — WO disclosed
US-20090163463-A1 Organic Compounds NOVARTIS AG 2009-06-25 — — US disclosed
US-20090163463-A1 Organic Compounds NOVARTIS AG 2009-06-25 — — US disclosed
WO-2009013348-A2 PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2009-01-29 — — WO 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 (4 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-20100298322-A1 Quinazolines and Related Heterocyclic Compounds, and Their Therapeutic Use RXFP3, RXFP1, NR1I3 ABL1 135/4885MAPK10 2701/4885BRD4 453/4885
US-20240269137-A1 HDAC6 INHIBITORS FOR TREATMENT OF DILATED CARDIOMYOPATHY HDAC6, HDAC1, HDAC2 ABL1 4666/4885MAPK10 1644/4885BRD4 303/4885
US-20230348441-A1 BICYCLIC COMPOUND THAT ACTS AS CRBN PROTEIN REGULATOR CRBN, CRKL, NCOR1 ABL1 1711/4885MAPK10 439/4885BRD4 1150/4885
US-20090163463-A1 Organic Compounds PIK3C3, PIK3CA, MTOR ABL1 238/4885MAPK10 83/4885BRD4 1393/4885

“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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