SCHEMBL1707296

SCHEMBL1707296

Cc1ccc2nc(NS(=O)(=O)c3ccccc3)n(C)c2c1.Cc1ccc2nc(NS(=O)(=O)c3ccccc3)n(C)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
METAP2 P50579 1/20 0.49
MAPT P10636 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 2/20 0.48
TSHR P16473 1/20 0.48
LMNA P02545 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
BRD4 O60885 1/20 0.45
BRD1 O95696 1/20 0.45
BRPF1 P55201 1/20 0.45
BRD9 Q9H8M2 1/20 0.45
BRPF3 Q9ULD4 1/20 0.45
TRIM24 O15164 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL978780 1.00 ALDH1A1 (0.58) ALDH1A1METAP2MAPTMEN1KMT2A
SCHEMBL977464 0.84 ALDH1A1 (0.61) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL1704422 0.74 KDM4E (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL26813752 0.72 HSD17B10 (0.58) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL26813759 0.72 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL7579963 0.71 METAP2 (0.69) ALDH1A1METAP2MAPTLMNAFFAR4
SCHEMBL20233035 0.70 RAB9A (0.51) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL27827007 0.70 FBP1 (0.61) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL578654 0.70 FFAR4 (0.68) ALDH1A1METAP2MAPTMEN1KMT2A
SCHEMBL1104822 0.70 ATM (0.55) ALDH1A1MAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440295-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS Janssen Pharmaceutica, N.V. (BE) 2012-04-18 EP disclosed
WO-2010144679-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-12-16 WO disclosed