SCHEMBL3957121

SCHEMBL3957121

CC(=O)C(c1ccccc1)(c1ccccc1)N1CCN(C(=O)c2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ SLC6A7 Q99884 1/20 0.52
▸ HSD11B1 P28845 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ POLB P06746 1/20 0.48
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA7 P43166 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ CA14 Q9ULX7 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ ATM Q13315 1/20 0.46

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
SCHEMBL22305103 0.76 CA12 (0.71) MEN1KMT2ASLC6A7HSD11B1L3MBTL1
SCHEMBL6985975 0.76 CA12 (0.71) MEN1KMT2ASLC6A7HSD11B1L3MBTL1
SCHEMBL7848596 0.75 POLB (0.62) MEN1KMT2ASLC6A7HSD11B1L3MBTL1
SCHEMBL3047748 0.73 CA12 (0.63) MEN1KMT2ASLC6A7HSD11B1L3MBTL1
SCHEMBL9364495 0.72 EPHX2 (0.77) MEN1KMT2AHSD11B1L3MBTL1POLB
SCHEMBL5026280 0.72 HRH3 (0.44) KMT2AALDH1A1
SCHEMBL2629513 0.70 BLM (0.60) POLBALDH1A1
SCHEMBL3093680 0.70 CA12 (0.59) MEN1KMT2ASLC6A7HSD11B1L3MBTL1
SCHEMBL12698681 0.70 CA12 (0.50) MEN1KMT2APOLBCA12CA1
SCHEMBL31350717 0.70 MAOB (0.80) MEN1KMT2ASLC6A7POLBCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670775-A4 PIPERAZINE SUBTITUTED COMPOUNDS USED AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD (CA) 2009-04-22 — — EP claimed
JP-2007504174-A — — 2007-03-01 — — JP claimed
EP-1670775-A1 PIPERAZINE SUBTITUTED COMPOUNDS USED AS CALCIUM CHANNEL BLOCKERS Neuromed Pharmaceuticals, Ltd. (CA) 2006-06-21 — — EP claimed
WO-2005021523-A1 PIPERAZINE SUBSTITUTED COMPOUNDS USED AS CALCIUM CHANNEL BLOCKERS NEUROMED TECHNOLOGIES, INC. (CA) 2005-03-10 — — WO claimed
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