SCHEMBL7736377

SCHEMBL7736377

CC(C)=CCCC1=CCC(CCc2ccc(O)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
FNTA P49354 2/20 0.42
PGGT1B P53609 1/20 0.42
PKM P14618 1/20 0.40
MCL1 Q07820 8/20 0.38
BCL2L1 Q07817 5/20 0.38
FNTB P49356 1/20 0.38
MAOB P27338 1/20 0.37
ESR2 Q92731 1/20 0.36
BCL2 P10415 6/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL7736956 0.87 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL7739452 0.86 ALDH1A1 (0.42) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL7729673 0.79 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL7736954 0.78 MEN1 (0.39) MEN1KMT2AALDH1A1MAPT
SCHEMBL7736938 0.78 ALDH1A1 (0.50) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL9054098 0.78 ALDH1A1 (0.46) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL28487258 0.77 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL21609554 0.77 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL1716694 0.77 MEN1 (0.51) MEN1KMT2AALDH1A1MAPTFNTA
SCHEMBL7737586 0.75 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTFNTA

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-6413448-B1 ESTERS; DOPANTS; LONGER CHIRAL SMECTIC PHASE PITCH; HIGHER TILT ANGLE; LOWER VISCOSITY; CRYSTALLIZATION SUPPRESSION; IMPROVED SOLUBILITY; BROADER C* PHASE TEMPERATURE RANGE DISPLAYTECH, INC. 2002-07-02 US disclosed
WO-2000065801-A9 CYCLOHEXYL- AND CYCLOHEXENYL-SUBSTITUTED LIQUID CRYSTALS WITH LOW BIREFRINGENCE DISPLAYTECH INC (US) 2001-04-12 WO disclosed
WO-2000065801-A1 CYCLOHEXYL- AND CYCLOHEXENYL-SUBSTITUTED LIQUID CRYSTALS WITH LOW BIREFRINGENCE DISPLAYTECH, INC. (US) 2000-11-02 WO disclosed