SCHEMBL5836800

SCHEMBL5836800

CC(C)c1cnc(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)s1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.60
KMT2A Q03164 4/20 0.60
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
MAPT P10636 3/20 0.60
MGAM O43451 3/20 0.60
GAA P10253 3/20 0.60
SI P14410 3/20 0.60
MGAM2 Q2M2H8 3/20 0.60
MEN1 O00255 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
ALDH1A1 P00352 4/20 0.59
HPGD P15428 4/20 0.59
CCNE1 P24864 2/20 0.52
CDK2 P24941 2/20 0.52
CDK5 Q00535 2/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL5835126 0.85 KMT2A (0.65) KMT2ANPC1RAB9AMAPTMGAM
SCHEMBL5836138 0.80 MEN1 (0.48) KDM4EKMT2ANPC1RAB9AMAPT
SCHEMBL5835708 0.80 CDK2 (0.75) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL5835787 0.79 CCNE1 (0.59) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL5836453 0.79 MCHR1 (0.50) KDM4EKMT2ANPC1RAB9AMAPT
SCHEMBL5835615 0.79 KMT2A (0.67) KDM4EKMT2AMAPTMGAMGAA
SCHEMBL5835633 0.77 KMT2A (0.65) KDM4EKMT2ANPC1RAB9AMAPT
SCHEMBL5836000 0.76 CCNE1 (0.77) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL5835048 0.75 MEN1 (0.64) KMT2ANPC1RAB9AMAPTMGAM
SCHEMBL6285422 0.74 ATG4B (0.63) KMT2ANPC1RAB9AMAPTMEN1

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 6 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 claimed
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 claimed
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 claimed
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