SCHEMBL9750773

SCHEMBL9750773

CCCCCC(C)(C)C(C)OC(C)C(C)(C)CCCCC

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 3/20 0.32
THRB P10828 1/20 0.32
SMPD1 P17405 3/20 0.31
CNR1 P21554 4/20 0.31
CNR2 P34972 4/20 0.31
FDPS P14324 3/20 0.31
GGPS1 O95749 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9750877 0.93
SCHEMBL26114113 0.84 CES2 (0.32) OPRM1SMN1; SMN2TSHRTHRBSMPD1
SCHEMBL9750759 0.82 LMNA (0.32) TSHRLMNAHSD17B10
SCHEMBL6890026 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL7051463 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL10420582 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL6890657 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL6892309 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL6890759 0.82 CES2 (0.35) TSHRTHRBSMPD1CNR1CNR2
SCHEMBL6330000 0.80 SMPD1 (0.35) OPRM1TSHRTHRBSMPD1FDPS

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
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed