SCHEMBL8976831

CCCCCCCCCCCCCCCCCCOC(=O)CCc1cc(C(C)(C)C)c(OP2N(c3ccccc3)P(Oc3c(C(C)(C)C)cc(CCC(=O)OCCCCCCCCCCCCCCCCCC)cc3C(C)(C)C)N2c2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	P2RY10	O00398	8/20	0.40

▸	LMNA	P02545	1/20	0.40

▸	CNR2	P34972	3/20	0.39

▸	TDP1	Q9NUW8	1/20	0.39

▸	THRA	P10827	1/20	0.38

▸	THRB	P10828	1/20	0.38

▸	CNR1	P21554	1/20	0.38

▸	GPR174	Q9BXC1	3/20	0.37

▸	GPR34	Q9UPC5	2/20	0.37

▸	ALOX5	P09917	1/20	0.37

▸	S1PR4	O95977	1/20	0.37

▸	S1PR1	P21453	1/20	0.37

▸	S1PR3	Q99500	1/20	0.37

▸	NTRK1	P04629	1/20	0.36

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.

Compound	similarity	top predicted	shared targets
SCHEMBL8976832	0.85	THRA (0.39)	P2RY10CNR2THRATHRBCNR1
SCHEMBL10789260	0.81	DGKA (0.40)	P2RY10CNR2THRATHRBCNR1
SCHEMBL17171797	0.79	DGKA (0.45)	CNR2THRATHRBCNR1ALOX5
Phenol SCHEMBL7771414	0.79	CNR2 (0.48)	P2RY10LMNACNR2TDP1CNR1
Phenol SCHEMBL11148764	0.79	CNR2 (0.48)	P2RY10LMNACNR2TDP1CNR1
SCHEMBL11569799	0.78	CNR2 (0.41)	P2RY10LMNACNR2TDP1THRA
SCHEMBL10611247	0.78	THRA (0.38)	P2RY10CNR2THRATHRBCNR1
SCHEMBL9339261	0.78	DGKA (0.49)	P2RY10CNR2THRATHRBCNR1
SCHEMBL8395870	0.77	EPHX2 (0.40)	P2RY10LMNACNR2THRATHRB
SCHEMBL9658153	0.77	CNR2 (0.35)	P2RY10LMNACNR2TDP1THRA

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-5534646-A	OXIDATION RESISTANCE FOR POLYMERS	CIBA-GEIGY CORPORATION (US)	1996-07-09	—	—	US	disclosed