SCHEMBL15225121

SCHEMBL15225121

CCCCCCCC(OP(O)O)(c1ccc(C(C)(C)C)cc1C)c1ccc(C(C)(C)C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.41
CNR1 P21554 14/20 0.41
ESR1 P03372 3/20 0.36
ESR2 Q92731 1/20 0.36
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
STS P08842 1/20 0.34

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
SCHEMBL2873121 0.90 CNR2 (0.36) CNR2CNR1HDAC3HDAC1HDAC2
SCHEMBL11390865 0.83 HDAC3 (0.41) CNR2CNR1ESR1ESR2HDAC3
SCHEMBL1578101 0.80 CNR2 (0.36) CNR2CNR1ESR1ESR2HDAC3
SCHEMBL10415162 0.80 CNR2 (0.34) CNR2CNR1HDAC3HDAC1HDAC2
SCHEMBL11084190 0.78 CNR1 (0.34) CNR2CNR1
SCHEMBL4254882 0.76 CNR2 (0.38) CNR2CNR1ESR1ESR2
SCHEMBL13571637 0.74 CNR1 (0.36) CNR2CNR1
SCHEMBL2365059 0.74 ALDH1A1 (0.38) ESR1
SCHEMBL11499489 0.73 HDAC3 (0.38) CNR2CNR1ESR1ESR2HDAC3
SCHEMBL28321176 0.73 ESR1 (0.40) CNR2CNR1ESR1ESR2STS

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-2272889-B1 POLYCARBONATE RESIN HAVING ULTRAVIOLET ABSORBING CAPABILITY, RESIN COMPOSITION AND OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2013-09-04 EP disclosed