SCHEMBL5839769

SCHEMBL5839769

NCC(=O)Nc1ncc(Cl)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.49
FFAR2 O15552 2/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
NPY1R P25929 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 2/20 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
SCHEMBL7936040 0.83 ALOX15 (0.52) ALOX15FFAR2SMN1; SMN2NPC1RAB9A
SCHEMBL27545748 0.80 ALOX15 (0.53) ALOX15FFAR2SMN1; SMN2NPC1RAB9A
SCHEMBL5837008 0.80 SMN1; SMN2 (0.56) ALOX15FFAR2SMN1; SMN2NPC1RAB9A
SCHEMBL21578016 0.79 KDM4E (0.60) ALOX15FFAR2MEN1KMT2AALDH1A1
SCHEMBL16086080 0.78 ALOX15 (0.54) ALOX15FFAR2SMN1; SMN2NPC1RAB9A
SCHEMBL966406 0.77 ALOX15 (0.53) ALOX15FFAR2LMNAMAPTMEN1
SCHEMBL5835745 0.76 MAPT (0.50) ALOX15FFAR2SMN1; SMN2LMNAMAPT
SCHEMBL21533493 0.74 ALDH1A1 (0.62) LMNAALDH1A1
SCHEMBL28089066 0.74 FFAR2 (0.50) ALOX15FFAR2SMN1; SMN2NPC1RAB9A
SCHEMBL6279225 0.72 FFAR2 (0.49) ALOX15FFAR2

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
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US disclosed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP disclosed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP disclosed