SCHEMBL9748237

SCHEMBL9748237

Cc1cc(C(=O)Cl)c2ccccn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ FNTA P49354 3/20 0.43
▸ FNTB P49356 3/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ THRB P10828 1/20 0.42
▸ TP53 P04637 2/20 0.40
▸ SSTR4 P31391 1/20 0.40
▸ BAZ2B Q9UIF8 6/20 0.40
▸ BAZ2A Q9UIF9 6/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ NOTUM Q6P988 2/20 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
SCHEMBL9531120 0.84 FNTA (0.59) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL16261172 0.76 SSTR4 (0.46) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL16261173 0.75 ALDH1A1 (0.48) ALDH1A1GAAHPGDNPSR1RXFP1
SCHEMBL7449672 0.72 BAZ2B (0.46) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL21696287 0.72 TP53 (0.49) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL9531363 0.72 HTR3A (0.56) ALDH1A1
SCHEMBL21696256 0.71 SSTR4 (0.40) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL8404415 0.71 KDM4E (0.43) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28448668 0.69 MAPT (0.48) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL9533942 0.69 BAZ2B (0.42) KDM4EALDH1A1GLAGAAHPGD

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-0254584-B1 AZABICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE BEECHAM GROUP PLC (GB) 1992-10-07 — — EP disclosed
US-4822795-A Pharmaceutically useful esters and amides BEECHAM GROPUP P.L.C. (GB) 1989-04-18 — — US disclosed
EP-0254584-A2 Azabicyclic compounds, process for their preparation, and their pharmaceutical use BEECHAM GROUP PLC (GB) 1988-01-27 — — EP disclosed
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