SCHEMBL4189434

SCHEMBL4189434

O=C(Cc1ccc(Cl)cc1)C1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.46
HPGD P15428 2/20 0.44
HRH1 P35367 1/20 0.41
MEN1 O00255 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
PIK3CA P42336 1/20 0.41
KMT2A Q03164 1/20 0.41
GRM7 Q14831 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
SCHEMBL2044549 0.88 LMNA (0.58) LMNAPOLBHPGDMEN1CYP3A4
SCHEMBL31202616 0.83 SMN1; SMN2 (0.46) LMNAHPGDMEN1MAPTKMT2A
SCHEMBL3953274 0.83 NMT2 (0.46) POLB
SCHEMBL32667549 0.83 MEN1 (0.57) POLBHPGDMEN1KMT2A
SCHEMBL1477277 0.83 GBA1 (0.50) LMNAHPGDHRH1MEN1KMT2A
SCHEMBL23086069 0.83 EPHX2 (0.52) PIK3CA
Hydrochloric Acid SCHEMBL1475977 0.82 NMT2 (0.46) POLBMEN1KMT2A
Hydrochloric Acid SCHEMBL9310454 0.81 GBA1 (0.49) LMNAHPGDHRH1MEN1KMT2A
SCHEMBL31693930 0.81 DPP4 (0.44)
SCHEMBL652791 0.78 LMNA (0.79) LMNAPOLBHPGDMEN1KMT2A

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-1784401-A4 UREA DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD (CA) 2009-07-15 EP disclosed
EP-1784401-A1 UREA DERIVATIVES AS CALCIUM CHANNEL BLOCKERS Neuromed Pharmaceuticals, Ltd. (CA) 2007-05-16 EP disclosed
WO-2006024160-A1 UREA DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2006-03-09 WO disclosed