SCHEMBL16601604

SCHEMBL16601604

Cc1nc(-c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2)cs1

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.77
KDM1A O60341 8/20 0.66
MAOA P21397 3/20 0.66
HPGD P15428 2/20 0.65
LMNA P02545 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
KDM4E B2RXH2 2/20 0.59
HTT P42858 2/20 0.58
ALDH1A1 P00352 1/20 0.58
CES1 P23141 1/20 0.56
NPSR1 Q6W5P4 1/20 0.55

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
SCHEMBL13341102 0.84 KDM1A (0.62) MAPTKDM1AMAOALMNAMEN1
SCHEMBL2405184 0.80 RAB9A (0.71) MAPTHPGDLMNAMEN1KMT2A
SCHEMBL8356809 0.80 KDM1A (1.00) KDM1AMAOAMEN1KMT2ANPSR1
SCHEMBL19976508 0.79 MAPT (0.64) MAPTKDM1AMAOAHPGDLMNA
SCHEMBL3139618 0.78 MAPT (0.70) MAPTKDM1AMAOAHPGDLMNA
SCHEMBL956179 0.77 ALDH1A1 (0.64) MAPTKDM1AMAOAHPGDLMNA
SCHEMBL6554630 0.75 CES1 (1.00) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL2474197 0.75 CES1 (1.00) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL3451075 0.75 KDM1A (0.83) KDM1AMAOANPSR1
SCHEMBL16509523 0.75 MAPT (0.59) MAPTHPGDLMNAHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993585-B2 Cyclic amine substituted pyrimidinediamines as PKC inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed