SCHEMBL9824604

SCHEMBL9824604

CC(=O)CC(=O)Nc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
ACHE P22303 1/20 0.55
MAPT P10636 4/20 0.54
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP3A4 P08684 1/20 0.53
PLCG1 P19174 1/20 0.51
HDAC1 Q13547 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
CNR2 P34972 1/20 0.49
CYP2D6 P10635 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL2346035 0.88 ALDH1A1 (0.67) ALDH1A1CYP1A2CYP2C19MEN1KMT2A
SCHEMBL31570071 0.87 ALDH1A1 (0.47) ALDH1A1ACHEMAPTCYP2C19MEN1
SCHEMBL10628943 0.86 ACHE (0.53) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL25037396 0.85 ACHE (0.57) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL22057590 0.84 ALDH1A1 (0.59) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL31090296 0.84 ALDH1A1 (0.59) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL8288255 0.84 ACHE (0.56) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL25037229 0.84 ACHE (0.56) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL30038413 0.84 ACHE (0.56) ALDH1A1ACHEMAPTCYP1A2CYP2C19
SCHEMBL3000567 0.84 ACHE (0.56) ALDH1A1ACHEMAPTCYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0200134-B1 5,6-Dihydroimidazo[2,1-b]thiazole-2-carboxamide derivatives or salts thereof KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1991-08-14 EP disclosed
US-4910315-A Containing a phenyl substitution KUMIAI CHEMICAL INDUSTRY CO. (JP) 1990-03-20 US disclosed
US-4736038-A IMMUNOLOGY KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-04-05 US disclosed
EP-0200134-A2 5,6-Dihydroimidazo[2,1-b]thiazole-2-carboxamide derivatives or salts thereof KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1986-11-05 EP disclosed