SCHEMBL10919360

SCHEMBL10919360

O=C1Nc2ccc(O)c(Cl)c2CO1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MB P02144 1/20 0.36
▸ CYP11B1 P15538 2/20 0.34
▸ CYP11B2 P19099 2/20 0.34
▸ CYP3A4 P08684 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PSMB5 P28074 1/20 0.31
▸ P2RX7 Q99572 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
SCHEMBL31180367 0.80 HTR2A (0.37) CYP11B1CYP11B2
SCHEMBL20597396 0.76 PARP1 (0.38) MBCYP11B1CYP11B2CYP3A4
SCHEMBL20714433 0.73 PDE7A (0.39) MBCYP3A4MAPK1PSMB5
SCHEMBL31180313 0.72 HTR5A (0.44) CYP11B1CYP11B2
SCHEMBL286755 0.70 KCNJ1 (0.44) CYP3A4MAPK1PSMB5
SCHEMBL10916724 0.69 CYP11B1 (0.51) CYP11B1CYP11B2
SCHEMBL3604854 0.67 CYP11B1 (0.36) MBCYP11B1CYP11B2
SCHEMBL25190883 0.67 CYP11B1 (0.34) CYP11B1CYP11B2
SCHEMBL7565735 0.67 MB (0.39) MBCYP11B1CYP11B2
SCHEMBL10916352 0.67 CYP11B1 (0.40) CYP11B1CYP11B2

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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