SCHEMBL5693255

SCHEMBL5693255

CS(=O)(=O)c1ccc(N2N=CCC2c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 10/20 0.55
▸ RIPK1 Q13546 7/20 0.51
▸ PTGS1 P23219 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ GLA P06280 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CFTR P13569 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ GOPC Q9HD26 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL5693238 0.86 PTGS2 (0.57) PTGS2RIPK1PTGS1KDM4EALDH1A1
SCHEMBL6225415 0.86 CA1 (0.61) PTGS2PTGS1KDM4EALDH1A1GLA
SCHEMBL11066334 0.82 RIPK1 (0.50) RIPK1KDM4EALDH1A1GLAMEN1
SCHEMBL3679184 0.78 SMN1; SMN2 (0.52) RIPK1ALDH1A1CA1CA2MEN1
SCHEMBL27547538 0.78 CA1 (0.45) RIPK1ALDH1A1CA1CA2
SCHEMBL7908513 0.78 PTGS2 (0.39) PTGS2RIPK1PTGS1KDM4EALDH1A1
SCHEMBL25370685 0.78 MAPT (0.62) RIPK1ALDH1A1GAACA1CA2
SCHEMBL14315081 0.76 PTGS2 (0.39) PTGS2RIPK1PTGS1
SCHEMBL27556930 0.75 RIPK1 (0.44) RIPK1ALDH1A1
SCHEMBL5693406 0.74 PTGS2 (0.76) PTGS2PTGS1KDM4EALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1299682-C Use of pyrazoline derivatives for the preparation of a medicament for the prevention and/or treatment of cell proliferative diseases DEL DR ELSTEVE S A LAB (ES) 2007-02-14 — — CN claimed
EP-1384477-B1 UTILIZATION OF PYRAZOLINE DERIVATIVES IN THE PREPARATION OF A MEDICAMENT FOR THE PREVENTION AND/OR TREATMENT OF PROLIFERATIVE CELL DISEASES ESTEVE LABOR DR (ES) 2006-05-24 — — EP claimed
CN-1189459-C Pyrazoline derivatives, process for their preparation and their use as medicaments ESTEVE LABOR DR (ES) 2005-02-16 — — CN claimed
CN-1509171-A Use of pyrazoline derivatives for the preparation of a medicament for the prevention and/or treatment of cell proliferative diseases ��˹���IJ�ʿʵ���ҹɷ����޹�˾ 2004-06-30 — — CN claimed
EP-1083171-B1 PYRAZOLINE DERIVATIVES, THEIR PREPARATION AND APPLICATION AS MEDICAMENTS ESTEVE LABOR DR (ES) 2004-04-28 — — EP claimed
US-20040034082-A1 Utilization of pyrazoline derivatives in the preparation of a medicament for the prevention and/or treatment of proliferative cell diseases LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2004-02-19 — — US claimed
EP-1384477-A1 UTILIZATION OF PYRAZOLINE DERIVATIVES IN THE PREPARATION OF A MEDICAMENT FOR THE PREVENTION AND/OR TREATMENT OF PROLIFERATIVE CELL DISEASES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2004-01-28 — — EP claimed
CN-1307566-A Pyrazoline derivatives, their prep. and application as medicaments ESTEVE LABOR DR (ES) 2001-08-08 — — CN claimed
EP-1083171-A1 PYRAZOLINE DERIVATIVES, THEIR PREPARATION AND APPLICATION AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2001-03-14 — — EP claimed

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-20040034082-A1 Utilization of pyrazoline derivatives in the preparation of a medicament for the prevention and/or treatment of proliferative cell diseases VHL, MET, PRMT1 PTGS2 3894/4885RIPK1 2959/4885PTGS1 1996/4885

“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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