SCHEMBL8083264

SCHEMBL8083264

CCCCCCCCc1ccc(OP(=O)(Oc2ccc(CCCCCCCC)cc2)Oc2ccc(CCCCCCCC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.57
THRB P10828 2/20 0.53
THRA P10827 1/20 0.53
ESR1 P03372 2/20 0.52
ADRA2A P08913 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
CYP3A4 P08684 2/20 0.52
KDM4E B2RXH2 1/20 0.52
SHBG P04278 1/20 0.52
TP53 P04637 1/20 0.52
HSPD1 P10809 1/20 0.52
ADRB3 P13945 1/20 0.52
HTR2C P28335 1/20 0.52
HSPE1 P61604 1/20 0.52

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
SCHEMBL11063910 1.00 ENPP2 (0.57) ENPP2THRBTHRAESR1ADRA2A
SCHEMBL11068357 1.00 ENPP2 (0.57) ENPP2THRBTHRAESR1ADRA2A
SCHEMBL11067476 1.00 ENPP2 (0.57) ENPP2THRBTHRAESR1ADRA2A
SCHEMBL124087 1.00 ENPP2 (0.57) ENPP2THRBTHRAESR1ADRA2A
SCHEMBL11063981 0.98 ENPP2 (0.54) ENPP2THRBTHRAESR1ADRA2A
SCHEMBL1548161 0.94 ENPP2 (0.51) ENPP2THRBTHRAHTR2AS1PR1
SCHEMBL2132932 0.94 ENPP2 (0.51) ENPP2THRBTHRAHTR2AS1PR1
SCHEMBL3919113 0.94 ENPP2 (0.51) ENPP2THRBTHRAHTR2AS1PR1
SCHEMBL8151307 0.94 ENPP2 (0.51) ENPP2THRBTHRAHTR2AS1PR1
SCHEMBL2131189 0.94 ENPP2 (0.51) ENPP2THRBTHRAHTR2AS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4436654-A ORGANIC PHOSPHATE OR PHOSPHONATE AND TRICARBOXYLIC ESTER HITACHI, LTD. (JP) 1984-03-13 US claimed
EP-0712576-B1 Antifouling agent ASAHI DENKA KOGYO KK (JP) 2000-10-11 EP disclosed
EP-0599251-B1 Use in viscous coupling of a fluid comprising a polyorganosiloxane and a viscosity inhibitor COSMO OIL CO LTD (JP) 1998-02-04 EP disclosed
EP-0712576-A1 Antifouling agent ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1996-05-22 EP disclosed
EP-0599251-A1 Fluid composition for use in viscous coupling COSMO OIL COMPANY, LTD (JP) 1994-06-01 EP disclosed
US-4436654-A ORGANIC PHOSPHATE OR PHOSPHONATE AND TRICARBOXYLIC ESTER HITACHI, LTD. (JP) 1984-03-13 US disclosed