SCHEMBL16319183

SCHEMBL16319183

CCc1cc(F)ccc1Oc1ccc(C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.57
LPAR5 Q9H1C0 5/20 0.57
PTGER4 P35408 2/20 0.55
PTGER2 P43116 1/20 0.55
SLC6A4 P31645 7/20 0.50
HTR2A P28223 4/20 0.50
LTB4R Q15722 2/20 0.49
KCNH2 Q12809 2/20 0.49
TTR P02766 1/20 0.49
ALDH1A1 P00352 1/20 0.48
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
NR4A2 P43354 1/20 0.47

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
SCHEMBL16319519 0.86 SLC6A4 (0.50) LPAR1LPAR5PTGER4PTGER2SLC6A4
SCHEMBL16319927 0.84 LMNA (0.60) LPAR1LPAR5
SCHEMBL27150812 0.82 RXRA (0.56) LPAR1LPAR5PTGER4PTGER2TTR
SCHEMBL16319882 0.82 SLC6A4 (0.49) LPAR1LPAR5PTGER4PTGER2SLC6A4
SCHEMBL1750329 0.81 PTGER4 (0.56) LPAR1LPAR5PTGER4PTGER2TTR
SCHEMBL16319538 0.80 SLC6A4 (0.50) PTGER4PTGER2SLC6A4HTR2AKCNH2
SCHEMBL11604036 0.79 RXRA (0.56) LPAR1LPAR5PTGER4PTGER2NR4A2
SCHEMBL16319176 0.79 ALDH1A1 (0.55) ALDH1A1
SCHEMBL26936440 0.78 TTR (0.75) LPAR1LPAR5PTGER4PTGER2TTR
SCHEMBL28032622 0.77 CA12 (0.53) TTRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed