SCHEMBL9844485

SCHEMBL9844485

CCCCCCCCCCCCCCCCC(COP(O)O)(c1ccc(C(C)(C)C)cc1C(C)(C)C)c1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.35
CNR1 P21554 10/20 0.35
ESR1 P03372 5/20 0.35
ESR2 Q92731 3/20 0.35
NR5A2 O00482 1/20 0.33
NR5A1 Q13285 1/20 0.33
STS P08842 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
GHSR Q92847 1/20 0.32

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
SCHEMBL9844562 1.00 CNR2 (0.35) CNR2CNR1ESR1ESR2NR5A2
SCHEMBL9844558 0.90 CNR2 (0.35) CNR2CNR1ESR1ESR2STS
SCHEMBL9844479 0.90 CNR2 (0.35) CNR2CNR1ESR1ESR2STS
SCHEMBL2873121 0.80 CNR2 (0.36) CNR2CNR1STSHDAC3HDAC1
SCHEMBL5474293 0.77 NR5A2 (0.32) ESR1ESR2NR5A2NR5A1
SCHEMBL28518973 0.75 KDM4E (0.33) HDAC3HDAC1HDAC2
SCHEMBL10415162 0.75 CNR2 (0.34) CNR2CNR1STSHDAC3HDAC1
SCHEMBL13571746 0.73 THRA (0.34) ESR1NR5A2NR5A1HDAC3HDAC1
SCHEMBL15225121 0.72 CNR2 (0.41) CNR2CNR1ESR1ESR2STS
SCHEMBL1069506 0.72 CNR2 (0.33) CNR2CNR1STSHDAC3HDAC1

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
EP-0416321-A1 Crystalline polyolefin composition Chisso Corporation (JP) 1991-03-13 EP disclosed