SCHEMBL10916352

SCHEMBL10916352

O=C1Nc2cc(Cl)c(O)cc2CO1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.40
▸ CYP11B2 P19099 2/20 0.40
▸ CYP46A1 Q9Y6A2 1/20 0.36
▸ ADRA1A P35348 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ CHEK1 O14757 3/20 0.32
▸ PDE3B Q13370 2/20 0.32
▸ PDE3A Q14432 2/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31
▸ GRIN3A Q8TCU5 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ CMA1 P23946 1/20 0.31

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
SCHEMBL10915997 0.76 CYP3A4 (0.44) CYP11B1CYP11B2TSHRGAANPSR1
SCHEMBL10916724 0.76 CYP11B1 (0.51) CYP11B1CYP11B2PDE3BPDE3AKCNH2
SCHEMBL30646022 0.72 CYP11B1 (0.41) CYP11B1CYP11B2PDE3BPDE3A
SCHEMBL2411213 0.72 CYP19A1 (0.48) CYP11B1CYP11B2CMA1AHRCYP19A1
SCHEMBL293956 0.72 CYP11B1 (0.41) CYP11B1CYP11B2PDE3BPDE3A
SCHEMBL3068531 0.72 AHR (0.56) CYP11B1CYP11B2CYP46A1PDE3BPDE3A
SCHEMBL10917967 0.71 CYP3A4 (0.34) CYP11B1CYP11B2HPGDHSD17B10PDE3B
SCHEMBL10919360 0.67 MB (0.36) CYP11B1CYP11B2
SCHEMBL26774120 0.67 MAPT (0.41) HPGDHSD17B10KDM4EGAASMN1; SMN2
SCHEMBL14728002 0.66 CYP11B1 (0.39) CYP11B1CYP11B2HPGDPDE3BPDE3A

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
EP-0093922-B1 BENZOXAZIN-2-ONES, THEIR PREPARATION AND THERAPEUTIC AGENTS CONTAINING THESE COMPOUNDS Dr. Karl Thomae GmbH (DE) 1986-12-30 — — EP disclosed
US-4518597-A THROMBOSIS, ARTERIOSCLEROSIS, ANTITUMOR, ANTICOAGULANTS DR. KARL THOMAE GMBH (DE) 1985-05-21 — — US disclosed
EP-0093922-A2 Benzoxazin-2-ones, their preparation and therapeutic agents containing these compounds Dr. Karl Thomae GmbH (DE) 1983-11-16 — — EP disclosed
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