SCHEMBL9866510

SCHEMBL9866510

COC(=O)C(O)c1cc2ccccc2n1C

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.51
▸ DAO P14920 1/20 0.44
▸ KMT2A Q03164 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ PHGDH O43175 1/20 0.42
▸ AHR P35869 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ SLC9A1 P19634 1/20 0.41
▸ MAPT P10636 1/20 0.40

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
SCHEMBL6188130 0.85 MCL1 (0.51) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL21807358 0.84 MCL1 (0.57) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL18358089 0.84 MCL1 (0.50) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL11600616 0.75 MCL1 (0.53) MCL1DAOKMT2APHGDHMEN1
SCHEMBL31291305 0.75 MCL1 (0.53) MCL1DAOKMT2APHGDHMEN1
SCHEMBL9868488 0.74 MCL1 (0.57) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL27852170 0.74 MCL1 (0.57) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL28360338 0.73 MCL1 (0.46) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL10514487 0.72 MCL1 (0.48) MCL1DAOKMT2ANPC1RAB9A
SCHEMBL13354733 0.72 KMT2A (0.49) MCL1DAOKMT2APHGDHMEN1

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-5017584-A Antidepressant 2-(4,5-dihydro-1H-imidazolyl)-dihydro-1H-indoles, -1,2,3,4-tetrahydroquinolines and -1H-indoles, and methods of use thereas STERLING DRUG INC. (US) 1991-05-21 — — US disclosed
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