SCHEMBL14818001

SCHEMBL14818001

Cc1ccc(CC(=O)N2CCCC2c2ccccn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ AADAT Q8N5Z0 2/20 0.51
▸ PRMT5 O14744 1/20 0.50
▸ WDR77 Q9BQA1 1/20 0.50
▸ PRCP P42785 1/20 0.47
▸ GRIN2B Q13224 1/20 0.47
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ HSD11B1 P28845 1/20 0.44
▸ ADAM17 P78536 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL12459662 0.88 PPID (0.48) AADATPRMT5WDR77PRCPNPC1
SCHEMBL19961321 0.83 ALDH1A1 (0.48) KDM4EAADATPOLBALDH1A1MAPT
SCHEMBL13212080 0.82 PRMT5 (0.53) KDM4EPRMT5WDR77NPC1RAB9A
SCHEMBL19409993 0.80 HSD11B1 (0.48) PRMT5WDR77NPC1RAB9AHSD11B1
SCHEMBL9289727 0.78 SMN1; SMN2 (0.48) SMN1; SMN2KDM4EAADATPRCPDRD4
SCHEMBL1329027 0.77 HSD11B1 (0.55) PRMT5WDR77NPC1RAB9AHSD11B1
SCHEMBL38659451 0.76 HSD11B1 (0.51) PRMT5WDR77NPC1RAB9AHSD11B1
SCHEMBL8296762 0.76 HSD11B1 (0.51) PRMT5WDR77NPC1RAB9AHSD11B1
SCHEMBL2306967 0.74 HHAT (0.55) PRCP
SCHEMBL12567634 0.73 PRCP (0.51) SMN1; SMN2KDM4EAADATPRCPPOLB

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
EP-1802636-B1 PI3 KINASES INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2013-03-27 — — EP disclosed
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