SCHEMBL5567494

SCHEMBL5567494

NS(=O)(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 6/20 0.58
CA1 P00915 7/20 0.55
CA2 P00918 7/20 0.55
CA9 Q16790 7/20 0.55
CA12 O43570 6/20 0.55
CA14 Q9ULX7 4/20 0.55
PTK2 Q05397 3/20 0.54
AURKA O14965 1/20 0.53
AURKB Q96GD4 1/20 0.53
CA4 P22748 3/20 0.51
CA6 P23280 3/20 0.51
CA7 P43166 3/20 0.51
CA13 Q8N1Q1 3/20 0.51
CA5A P35218 2/20 0.51
CDK2 P24941 5/20 0.51
CCNT1 O60563 2/20 0.51
CCNB1 P14635 2/20 0.51
CDK9 P50750 2/20 0.51
CDK7 P50613 1/20 0.51
CCNH P51946 1/20 0.51

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
SCHEMBL31444232 0.90 CA1 (0.52) CDK1CA1CA2CA9CA12
SCHEMBL5561870 0.87 CDK2 (0.64) CDK1PTK2AURKAAURKBCDK2
SCHEMBL31180415 0.85 PTK2 (0.56) CDK1PTK2AURKACDK2CCNT1
SCHEMBL31180414 0.85 PTK2 (0.56) CDK1PTK2AURKACDK2CCNT1
SCHEMBL1917337 0.82 STK17A (0.60) CDK1PTK2AURKAKDR
SCHEMBL31444285 0.82 LRRK2 (0.50) CDK1CA1CA2CA9PTK2
SCHEMBL29631616 0.82 PTK2 (0.49) CDK1PTK2AURKACDK2CCNT1
SCHEMBL24477765 0.81 CDK2 (0.60) CDK1CA1CA2CA9PTK2
SCHEMBL15506892 0.81 AURKA (0.48) CDK1PTK2AURKACDK2KDR
SCHEMBL3284454 0.80 CDK1 (0.53) CDK1PTK2AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532473-A1 AMINOHETEROARYL KINASE INHIBITORS Allorion Therapeutics Inc. (US) 2025-04-09 EP disclosed
CN-119343333-A Amino heteroaryl kinase inhibitors 安锐生物医药公司 2025-01-21 CN disclosed
US-20240166635-A1 AMINOHETEROARYL KINASE INHIBITORS Allorion Therapeutics Inc 2024-05-23 US disclosed
EP-4251613-A1 AMINOHETEROARYL KINASE INHIBITORS Allorion Therapeutics Inc. (US) 2023-10-04 EP disclosed
CN-116528869-A Amino heteroaryl kinase inhibitors 安锐生物医药科技(广州)有限公司 2023-08-01 CN disclosed
WO-2022111621-A1 AMINOHETEROARYL KINASE INHIBITORS ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2022-06-02 WO disclosed
WO-2022111621-A1 AMINOHETEROARYL KINASE INHIBITORS ANRUI BIOMEDICAL TECHNOLOGY (GUANGZHOU) CO., LTD. (CN) 2022-06-02 WO disclosed
CN-100465164-C CF3Selective synthesis of-substituted pyrimidines PFIZER (US) 2009-03-04 CN disclosed
EP-1663991-B1 SELECTIVE SYNTHESIS OF CF3-SUBSTITUTED PYRIMIDINES PFIZER PROD INC (US) 2007-01-10 EP disclosed
US-7122670-B2 Selective synthesis of CF3-substituted pyrimidines PFIZER INC (US) 2006-10-17 US disclosed
CN-1845906-A Selective synthesis of CF 3-substituted pyrimidines PFIZER (US) 2006-10-11 CN disclosed
EP-1663991-A1 SELECTIVE SYNTHESIS OF CF3-SUBSTITUTED PYRIMIDINES Pfizer Products Inc. (US) 2006-06-07 EP disclosed
US-20050101620-A1 Selective synthesis of CF3-substituted pyrimidines PFIZER INC. 2005-05-12 US disclosed
WO-2005023780-A1 SELECTIVE SYNTHESIS OF CF3-SUBSTITUTED PYRIMIDINES PFIZER PRODUCTS INC. (US) 2005-03-17 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 (2 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-20050101620-A1 Selective synthesis of CF3-substituted pyrimidines HNRNPH3, HNRNPA3, NUDT1 CDK1 541/4885CA1 2896/4885CA2 3640/4885
US-20240166635-A1 AMINOHETEROARYL KINASE INHIBITORS CDK2, CDK3, CDKL1 CDK1 6/4885CA1 4314/4885CA2 3798/4885

“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.