SCHEMBL10515427

SCHEMBL10515427

O=C(O)C1Cc2c(ccc3c(-c4ccccc4)noc23)O1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PPARA Q07869 8/20 0.36
▸ PPARG P37231 8/20 0.36
▸ PPARD Q03181 8/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CYP17A1 P05093 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL10511182 0.80 CYP17A1 (0.40) ALDH1A1PPARAPPARGPPARDKDM4E
SCHEMBL9273734 0.78 KDM4E (0.36) ALDH1A1SMN1; SMN2KMT2AKDM4EHPGD
SCHEMBL10512810 0.78 HTT (0.38) ALDH1A1SMN1; SMN2KMT2AKDM4EHPGD
SCHEMBL9827198 0.75 POLB (0.41) PPARAPPARGPPARDKMT2AMEN1
SCHEMBL10808391 0.72 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2KMT2AKDM4EHPGD
SCHEMBL9836636 0.71 PTGS2 (0.47) ALDH1A1SMN1; SMN2KMT2AKDM4EHPGD
SCHEMBL10512831 0.70 GPBAR1 (0.35) KDM4ECYP1A2
SCHEMBL10513130 0.69 POLB (0.43) ALDH1A1SMN1; SMN2KMT2AHPGDMEN1
SCHEMBL9827847 0.68 PPARG (0.42) PPARAPPARGPPARD
SCHEMBL10512118 0.68 POLB (0.46) ALDH1A1SMN1; SMN2KMT2AMEN1

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
JP-62228081-A — — None — — JP disclosed
EP-0205872-B1 FUROBENZISOXAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 1989-04-19 — — EP disclosed
US-4791209-A DIURETICS, HYPOTENSIVE AGENTS Chugai Seiyako Kabushiki Kaisha (JP) 1988-12-13 — — US disclosed
JP-S62228081-A FUROBENZISOXAZOLE DERIVATIVE CHUGAI PHARMACEUT CO LTD 1987-10-06 — — JP disclosed
EP-0205872-A1 Furobenzisoxazole derivatives Chugai Seiyaku Kabushiki Kaisha (JP) 1986-12-30 — — EP disclosed
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