SCHEMBL3864015

SCHEMBL3864015

CC(=O)C(c1ccccc1)(c1ccccc1)N1CCN(c2ccc([Si](C)(C)C)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ME2 P23368 1/20 0.41
▸ ME1 P48163 1/20 0.41
▸ ME3 Q16798 1/20 0.41
▸ MAPK1 P28482 2/20 0.40
▸ GCK P35557 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ NPY2R P49146 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ AKR1C3 P42330 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36

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
SCHEMBL5027734 0.85 USP2 (0.50) MEN1KMT2AME2ME1ME3
SCHEMBL3871229 0.79 MAPT (0.47) MEN1KMT2AME2ME1ME3
SCHEMBL5026280 0.72 HRH3 (0.44) KMT2A
SCHEMBL3861148 0.70 DRD2 (0.54) —
SCHEMBL5017426 0.70 RAB9A (0.60) MEN1KMT2AMAPK1NPC1RAB9A
SCHEMBL5026265 0.70 KMT2A (0.59) MEN1KMT2ANPC1MAPTCYP2C9
SCHEMBL8633964 0.68 KDM4E (0.45) MEN1KMT2AME2ME1ME3
SCHEMBL3862213 0.68 KMT2A (0.52) MEN1KMT2A
SCHEMBL5026259 0.68 CACNA2D1 (0.56) MAPTLMNAHPGD
Hydrochloric Acid SCHEMBL8838192 0.68 KDM4E (0.44) MEN1KMT2AME2ME1ME3

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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