SCHEMBL2299154

SCHEMBL2299154

c1cc2c(cc1C1CC1)CC[N]C2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
EPHX2 P34913 1/20 0.32
QDPR P09417 2/20 0.32
HDAC8 Q9BY41 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
PDK2 Q15119 1/20 0.30

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
SCHEMBL5585111 0.74 ALDH1A1 (0.35) EPHX2QDPR
SCHEMBL586129 0.71 LMNA (0.38)
SCHEMBL3245289 0.71 DRD2 (0.44)
SCHEMBL2303460 0.71 ASIC3 (0.46) HTR2CHTR2B
SCHEMBL5543517 0.71 PNMT (0.41)
SCHEMBL2301407 0.71 HTR2A (0.48) HTR2CHTR2B
SCHEMBL2296650 0.71 HTR5A (0.37)
SCHEMBL585671 0.71 HTR5A (0.37) HTR2CHTR2B
SCHEMBL29377232 0.69 EPHX2 (0.31) HDAC1HDAC6EPHX2QDPRHDAC8
SCHEMBL5584937 0.68

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-2536689-A1 ARYL CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS FOR TREATMENT OF PAIN Amgen Inc. (US) 2012-12-26 EP disclosed
WO-2011103196-A1 ARYL CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL INHIBITORS FOR TREATMENT OF PAIN AMGEN INC. (US) 2011-08-25 WO disclosed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO disclosed