SCHEMBL12831069

SCHEMBL12831069

CCc1cc2c(cc1OC)C(=O)N(C)CC2

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.75
▸ KMT2A Q03164 1/20 0.75
▸ GAA P10253 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ HTR2A P28223 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ HTR2B P41595 1/20 0.44
▸ GRM5 P41594 1/20 0.44
▸ LRRK2 Q5S007 2/20 0.43
▸ DRD2 P14416 2/20 0.43
▸ BRD4 O60885 2/20 0.43
▸ HSD17B1 P14061 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.41

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
SCHEMBL11923834 0.86 MEN1 (1.00) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL30883376 0.86 MEN1 (1.00) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL31260453 0.82 MEN1 (0.79) MEN1KMT2AGAASMN1; SMN2HTR2A
SCHEMBL16519579 0.82 MEN1 (0.79) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL24869723 0.78 MEN1 (0.77) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL30875685 0.78 MEN1 (0.77) MEN1KMT2AGAASMN1; SMN2GRM5
Thalifoline SCHEMBL29961712 0.78 MEN1 (0.77) MEN1KMT2AGAASMN1; SMN2HTR2B
SCHEMBL25946921 0.77 MEN1 (0.75) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL14980800 0.75 MEN1 (0.73) MEN1KMT2AGAASMN1; SMN2GRM5
SCHEMBL6074018 0.75 MEN1 (0.73) MEN1KMT2AGAASMN1; SMN2GRM5

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
WO-2011025706-A2 HETEROCYCLIC AMIDE COMPOUNDS AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2011-03-03 — — WO disclosed
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