SCHEMBL7735652

SCHEMBL7735652

COc1ccc(-c2[c]c3ccc(OC)cc3cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
GSTP1 P09211 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2A6 P11509 1/20 0.46
CYP11B2 P19099 6/20 0.42
CYP11B1 P15538 5/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP17A1 P05093 3/20 0.41
CYP19A1 P11511 1/20 0.41
PLAU P00749 2/20 0.40
NISCH Q9Y2I1 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL9054823 0.90 CYP1A2 (0.52) HSD17B1HSD17B2NPC1RAB9AGSTP1
SCHEMBL11723042 0.89 CYP2A6 (0.52) HSD17B1HSD17B2NPC1RAB9ACASP3
SCHEMBL7937480 0.85 CYP1A2 (0.46) HSD17B1HSD17B2NPC1RAB9AGSTP1
SCHEMBL8734522 0.84 HSD17B1 (0.41) HSD17B1HSD17B2NPC1RAB9ACASP3
SCHEMBL5887550 0.83 NPC1 (0.46) NPC1RAB9ACASP3SENP7CYP1A2
SCHEMBL5144913 0.77 CYP2A6 (0.50) HSD17B1HSD17B2NPC1RAB9ACASP3
SCHEMBL9057774 0.76 CYP1A2 (0.47) NPC1RAB9AGSTP1CYP1A2CYP2A6
SCHEMBL8734451 0.75 GAPDH (0.53) NPC1RAB9ACASP3SENP7CYP3A4
SCHEMBL8732840 0.75 GAPDH (0.53) NPC1RAB9ACASP3SENP7CYP3A4
SCHEMBL9510748 0.75 CYP2A6 (0.48) HSD17B1HSD17B2NPC1RAB9ACASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410564-B1 Naphthyl compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY 2002-06-25 US disclosed
CN-1163567-A Method for reducing uterine nutritional effects of tamoxifen and tamoxifen analogues LILLY CO ELI (US) 1997-10-29 CN disclosed
WO-1996009051-A1 A METHOD FOR MINIMIZING THE UTEROTROPHIC EFFECT OF TAMOXIFEN AND TAMOXIFEN ANALOGS ELI LILLY AND COMPANY (US) 1996-03-28 WO disclosed
EP-0703228-A1 Naphthyl compounds, intermediates, processes, compositions involving them ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
US-5484795-A Naphthyl compounds, intermediates, processes, compositions, and method of inhibiting restenosis ELI LILLY AND COMPANY (US) 1996-01-16 US disclosed