SCHEMBL8990797

SCHEMBL8990797

CCCCCc1ccc(-c2ccc(CCc3ccc(OC(F)(F)F)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.49
RARB P10826 7/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MAPT P10636 2/20 0.46
RARA P10276 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
MTOR P42345 1/20 0.46
KMT2A Q03164 1/20 0.46
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
THRB P10828 1/20 0.44
RARG P13631 1/20 0.43
DAO P14920 1/20 0.43

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
SCHEMBL8990703 1.00 FAAH (0.49) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9061129 0.98 FAAH (0.50) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9061958 0.98 FAAH (0.50) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9061391 0.97 FAAH (0.53) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9425365 0.97 FAAH (0.53) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9060907 0.97 FAAH (0.53) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9425192 0.97 FAAH (0.53) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL9424951 0.97 FAAH (0.53) FAAHRARBTSHRHSD17B10MAPT
SCHEMBL8990723 0.95 RARB (0.46) FAAHRARBTSHRHSD17B10ALDH1A1
SCHEMBL8990970 0.95 RARB (0.46) FAAHRARBTSHRHSD17B10ALDH1A1

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-5496499-A Biphenylethanes and liquid-crystalline phase MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-03-05 US disclosed
EP-0429558-B1 DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE MERCK PATENT GMBH (DE) 1994-03-30 EP disclosed
WO-1990008757-A1 DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-08-09 WO disclosed