SCHEMBL1160157

SCHEMBL1160157

CCCCCC(C)(C)c1cc(C(C)(C)C)c(OP(O)Oc2cc(C)c(C(C)(C)CCCCC)cc2C(C)(C)C)cc1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.35
CNR1 P21554 13/20 0.34
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30

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
SCHEMBL1159820 0.95 CNR2 (0.35) CNR2CNR1LTB4RLTB4R2
SCHEMBL11177244 0.89 CNR2 (0.39) CNR2CNR1THRATHRB
SCHEMBL11181455 0.83 CNR2 (0.39) CNR2CNR1
SCHEMBL31572308 0.81 ALOX15 (0.36)
SCHEMBL11264571 0.81 ALOX15 (0.36)
SCHEMBL1003152 0.78 ESR1 (0.38) CNR2CNR1THRATHRB
SCHEMBL28700582 0.77 LMNA (0.32)
SCHEMBL1159756 0.77 CNR2 (0.42) CNR2CNR1
SCHEMBL8149736 0.74 CNR2 (0.49) CNR2CNR1
SCHEMBL9351488 0.74 ALOX15 (0.45) CNR2CNR1

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-8183311-B2 Liquid phosphite composition derived from cresols CHEMTURA CORPORATION (US) 2012-05-22 US disclosed
WO-2011014211-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS CHEMTURA CORPORATION (US) 2011-02-03 WO disclosed
US-20100076125-A1 LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS CHEMTURA CORPORATION (US) 2010-03-25 US disclosed