SCHEMBL4903620

SCHEMBL4903620

CCN(c1nc2cc(C)ccc2o1)S(=O)(=O)c1cc(C)c(C)c(C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C1R P00736 2/20 0.42
PRSS1 P07477 2/20 0.42
HPGD P15428 6/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 4/20 0.41
ALOX15 P16050 1/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
MAOB P27338 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
LMNA P02545 1/20 0.38
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37

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
SCHEMBL4896007 0.90 C1R (0.46) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4902845 0.89 NPC1 (0.38) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4903840 0.89 HPGD (0.47) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4895797 0.86 HPGD (0.46) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4905727 0.84 HPGD (0.47) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4906365 0.80 ALDH1A1 (0.42) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4904014 0.80 C1R (0.42) C1RPRSS1ALDH1A1MAOBLMNA
SCHEMBL4898294 0.79 C1R (0.49) C1RPRSS1HPGDALDH1A1HSD17B10
SCHEMBL4909040 0.79 LMNA (0.44) HPGDALDH1A1HSD17B10ALOX15LMNA
SCHEMBL4904431 0.78 C1R (0.45) C1RPRSS1HPGDALDH1A1HSD17B10

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 C1R 4367/4885PRSS1 1105/4885HPGD 724/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD C1R 4367/4885PRSS1 1105/4885HPGD 724/4885

“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.