SCHEMBL5875796

SCHEMBL5875796

CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
POLB P06746 1/20 0.59
TSHR P16473 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 3/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CYP2C9 P11712 1/20 0.53
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL2295550 0.89 KMT2A (0.60) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL5875625 0.89 TSHR (0.57) MEN1KMT2APOLBTSHRKDM4E
SCHEMBL4551788 0.89 POLB (0.60) MEN1KMT2APOLBTSHRKDM4E
SCHEMBL18891204 0.88 TSHR (0.56) MEN1KMT2APOLBTSHRKDM4E
Hydrochloric Acid SCHEMBL6196657 0.88 POLB (0.61) MEN1KMT2APOLBTSHRKDM4E
SCHEMBL13173304 0.87 KMT2A (0.57) MEN1KMT2APOLBTSHRALDH1A1
SCHEMBL18430905 0.87 TSHR (0.55) MEN1KMT2APOLBTSHRKDM4E
SCHEMBL5827157 0.87 CYP2C9 (0.65) MEN1KMT2APOLBTSHRKDM4E
SCHEMBL6993844 0.87 POLB (0.61) MEN1KMT2APOLBTSHRKDM4E
Hydrochloric Acid SCHEMBL6196650 0.87 POLB (0.58) MEN1KMT2APOLBTSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011154798-A1 NOVEL 1,4-DIAZEPAM PDE-5 INHIBITOR DERIVATIVES WORLD-TRADE IMPORT-EXPORT WTIE, AG (CH) 2011-12-15 WO disclosed
US-7005520-B2 Process for the preparation of pyrazolopyrimidinones PFIZER INC. (US) 2006-02-28 US disclosed
EP-1292586-B1 PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES PFIZER LTD (GB) 2004-08-04 EP disclosed
US-20040106796-A1 Novel process for the preparation of pyrazolopyrimidinones PFIZER INC 2004-06-03 US disclosed
US-6667398-B2 Reacting a benzamidine compound with a amide substituted pyrazole compound PFIZER INC 2003-12-23 US disclosed
EP-1292586-A1 PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES Pfizer Limited (GB) 2003-03-19 EP disclosed
US-20020013464-A1 Novel process for the preparation of pyrazolopyrimidinones PFIZER INC. 2002-01-31 US disclosed
WO-2001098284-A1 PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES PFIZER LIMITED (GB) 2001-12-27 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-20040106796-A1 Novel process for the preparation of pyrazolopyrimidinones CYP4F3, CYP3A4, NDUFS3 MEN1 2804/4885KMT2A 3952/4885POLB 2081/4885
US-20020013464-A1 Novel process for the preparation of pyrazolopyrimidinones CYP4F3, CYP3A4, NDUFS3 MEN1 2804/4885KMT2A 3952/4885POLB 2081/4885

“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.