SCHEMBL9617751

SCHEMBL9617751

CCCCc1ccc(-c2ccccc2)c(-c2cccc(F)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.51
HSD11B1 P28845 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
RARB P10826 1/20 0.40
LPL P06858 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
GPR3 P46089 1/20 0.40
LTB4R2 Q9NPC1 2/20 0.39
GCGR P47871 1/20 0.39
MGLL Q99685 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP2 P08253 1/20 0.37
MMP3 P08254 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
SCHEMBL4604288 0.88 PSMB5 (0.53) PSMB5HSD11B1RARBGPR3LTB4R2
SCHEMBL11325207 0.88 PSMB5 (0.61) PSMB5HSD11B1RARBLPLLIPG
SCHEMBL4604290 0.87 HTR7 (0.45) PSMB5TAAR1LPLLIPGMGLL
SCHEMBL8921404 0.86 TSHR (0.49) PSMB5TAAR1MGLL
SCHEMBL9225803 0.82 PSMB5 (0.47) PSMB5HSD11B1RARBGPR3LTB4R2
SCHEMBL26193728 0.80 RARB (0.55) PSMB5HSD11B1RARBGPR3MMP2
SCHEMBL5683080 0.80 RARB (0.46) PSMB5HSD11B1RARBLPLLIPG
SCHEMBL9060997 0.79 PSMB5 (0.45) PSMB5
SCHEMBL3160227 0.79 PSMB5 (0.41) PSMB5HSD11B1TAAR1GCGRMGLL
SCHEMBL28632619 0.79 TAAR1 (0.65) HSD11B1TAAR1RARBLTB4R2MGLL

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
JP-4266836-A None JP disclosed
JP-H04266836-A TERPHENYL DERIVATIVE, LIQUID CRYSTALLINE COMPOSITION CONTAINING THE SAME DERIVATIVE AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME COMPOSITION SEIKO EPSON CORP 1992-09-22 JP disclosed