SCHEMBL8054867

SCHEMBL8054867

CCCCCOC(C)CCCC=Cc1ccc(-c2ccc(-c3ccc(O)cc3F)nc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
ALOX5AP P20292 6/20 0.32
FEN1 P39748 6/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
MAPT P10636 1/20 0.31
STAT3 P40763 1/20 0.31
ATM Q13315 1/20 0.31
RARB P10826 1/20 0.31
HDAC1 Q13547 1/20 0.30

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
SCHEMBL8054863 1.00 USP7 (0.32) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8047632 0.95 FEN1 (0.33) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8047638 0.95 FEN1 (0.33) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8049284 0.95 NPC1 (0.36) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8049277 0.95 NPC1 (0.36) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8046419 0.94 ABCG2 (0.32) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8046416 0.94 ABCG2 (0.32) USP7ABCG2ALOX5APFEN1NPC1
SCHEMBL8047463 0.91 NPC1 (0.36) USP7ALOX5APFEN1NPC1RAB9A
SCHEMBL8047454 0.91 NPC1 (0.36) USP7ALOX5APFEN1NPC1RAB9A
SCHEMBL8036888 0.91 ABCG2 (0.34) USP7ABCG2ALOX5APFEN1RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed