SCHEMBL11319601

SCHEMBL11319601

OCCC1Cc2ccccc2N1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ PNMT P11086 5/20 0.44
▸ CREBBP Q92793 3/20 0.44
▸ MTNR1A P48039 3/20 0.39
▸ AR P10275 1/20 0.37
▸ BRD4 O60885 2/20 0.37

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
SCHEMBL16671960 1.00 GAA (0.47) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL14881136 0.89 PNMT (0.47) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL30288510 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL30681442 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL1193549 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL550431 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL2450511 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL29427458 0.85 CREBBP (0.59) GAAMAPTPNMTCREBBPMTNR1A
SCHEMBL7381467 0.81 HTR2A (0.46) GAAMAPTPNMTAR
SCHEMBL550098 0.81 CREBBP (0.44) GAAMAPTPNMTCREBBPMTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4261993-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC RHONE POULENC INDUSTRIES (FR) 1981-04-14 — — US disclosed
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