SCHEMBL4887050

SCHEMBL4887050

CCOC(=O)c1ccc(C(N)=O)cc1S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.48
MMP13 P45452 1/20 0.48
STS P08842 1/20 0.48
HPGD P15428 2/20 0.44
RECQL P46063 1/20 0.44
CA1 P00915 7/20 0.44
CA2 P00918 7/20 0.44
CA12 O43570 5/20 0.44
CA9 Q16790 5/20 0.44
CA7 P43166 4/20 0.44
CA14 Q9ULX7 4/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAOA P21397 1/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL4886502 0.84 CYP3A4 (0.47) HPGDCYP3A4TSHRALDH1A1KDM4E
SCHEMBL4883259 0.83 ALDH1A1 (0.47) HPGDLMNACYP3A4TSHRALDH1A1
SCHEMBL16990464 0.81 SLC9A1 (0.44) CA2MAPK1
SCHEMBL14687178 0.79 CA1 (0.46) HPGDRECQLCA1CA2CA12
SCHEMBL3472808 0.79 ALDH1A1 (0.49) CA1CA2CA12CA9CA7
SCHEMBL10597819 0.79 ALDH1A1 (0.58) MMP2MMP13STSHPGDCA1
SCHEMBL4605949 0.78 CA1 (0.50) STSHPGDRECQLCA1CA2
SCHEMBL4603460 0.78 ALDH1A1 (0.52) STSHPGDRECQLCA1CA2
SCHEMBL3338209 0.78 CA1 (0.50) STSHPGDRECQLCA1CA2
SCHEMBL4604672 0.78 CA1 (0.50) STSHPGDRECQLCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES ICAGEN, INC. (US) 2008-03-13 US disclosed
US-7223782-B2 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2007-05-29 US disclosed
US-20050049237-A1 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2005-03-03 US 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-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES SCN3A, TRPV3, HCN3 MMP2 4318/4885MMP13 2589/4885STS 250/4885
US-20050049237-A1 Pyrazole-amides and -sulfonamides SCN3A, TRPV3, HCN3 MMP2 4318/4885MMP13 2589/4885STS 250/4885

“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.