SCHEMBL4905552

SCHEMBL4905552

CCN(Sc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)S(=O)(=O)c1ccc(C)c(C(=O)OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
MMP9 P14780 6/20 0.38
MMP2 P08253 4/20 0.38
MMP13 P45452 3/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
BMP1 P13497 1/20 0.38
RORC P51449 1/20 0.36
CACNA1H O95180 1/20 0.36
CACNA1B Q00975 1/20 0.36
CFTR P13569 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
MMP1 P03956 1/20 0.36
ADAM17 P78536 1/20 0.36
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 1/20 0.35

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
SCHEMBL4906048 0.95 ALDH1A1 (0.45) ALDH1A1TSHRMMP3BMP1RORC
SCHEMBL4906844 0.91 POLB (0.41) MMP9MMP2MMP13MMP3MMP8
SCHEMBL4906561 0.91 ALDH1A1 (0.44) ALDH1A1TSHRMMP9MMP2MMP13
SCHEMBL4899562 0.90 ALDH1A1 (0.36) ALDH1A1TSHRMMP9MMP2MMP13
SCHEMBL4904866 0.89 ALDH1A1 (0.43) ALDH1A1TSHRMMP9MMP2MMP13
SCHEMBL4902853 0.89 ALDH1A1 (0.45) ALDH1A1TSHRMMP9MMP2MMP13
SCHEMBL4904025 0.89 ALDH1A1 (0.45) ALDH1A1TSHRMMP9MMP13KDM4E
SCHEMBL4905798 0.88 ALDH1A1 (0.44) ALDH1A1TSHRMMP9MMP13KDM4E
SCHEMBL4906314 0.88 ALDH1A1 (0.44) ALDH1A1TSHRMMP9MMP2MMP13
SCHEMBL4902656 0.88 LMNA (0.44) ALDH1A1TSHRMMP9MMP2MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-12-29 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-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885MMP9 4632/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885MMP9 4632/4885

“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.