SCHEMBL11227836

SCHEMBL11227836

CN1C(C(=O)Nc2coc3ccccc3c2=O)C(=O)c2ccccc2S1(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.53
▸ MAOB P27338 17/20 0.47
▸ ADORA2B P29275 2/20 0.37
▸ MAOA P21397 1/20 0.35

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
SCHEMBL11238856 0.89 ALDH1A1 (0.51) ALDH1A1MAOB
SCHEMBL11224073 0.88 MAOB (0.43) ALDH1A1MAOBADORA2B
SCHEMBL11234155 0.88 ALDH1A1 (0.52) ALDH1A1MAOB
SCHEMBL11238000 0.87 ALDH1A1 (0.46) ALDH1A1MAOBMAOA
SCHEMBL11245007 0.86 ALDH1A1 (0.52) ALDH1A1MAOB
SCHEMBL11227476 0.85 ALDH1A1 (0.46) ALDH1A1MAOB
SCHEMBL11235876 0.85 ALDH1A1 (0.48) ALDH1A1MAOB
SCHEMBL11232516 0.84 MAOB (0.39) ALDH1A1MAOBADORA2BMAOA
SCHEMBL11232506 0.82 ALDH1A1 (0.50) ALDH1A1MAOB
SCHEMBL11240239 0.81 ALDH1A1 (0.48) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327091-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1982-04-27 — — US claimed
EP-0003360-B1 AZATHIANAPHTHALENE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR UTILISATION CIBA-GEIGY AG (CH) 1981-12-30 — — EP claimed
US-4213980-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1980-07-22 — — US claimed
US-4327091-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1982-04-27 — — US disclosed
EP-0003360-B1 AZATHIANAPHTHALENE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR UTILISATION CIBA-GEIGY AG (CH) 1981-12-30 — — EP disclosed
US-4213980-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1980-07-22 — — US disclosed
EP-0003360-A1 Azathianaphthalene derivatives, process for their preparation, pharmaceutical preparations containing them and their utilisation CIBA-GEIGY AG (CH) 1979-08-08 — — EP disclosed
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