SCHEMBL9823912

SCHEMBL9823912

CC(=O)CC(=O)NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.66
SMN1; SMN2 Q16637 1/20 0.59
TRPV1 Q8NER1 2/20 0.57
HPGD P15428 1/20 0.56
P2RX7 Q99572 4/20 0.54
LMNA P02545 2/20 0.53
TP53 P04637 1/20 0.53
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
APEX1 P27695 1/20 0.51
TAOK1 Q7L7X3 1/20 0.50
TAOK3 Q9H2K8 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
F2 P00734 1/20 0.48
F10 P00742 1/20 0.48
F7 P08709 1/20 0.48

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
SCHEMBL11305715 0.90 TSHR (0.69) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL5653386 0.85 TSHR (0.63) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL6361222 0.85 TSHR (0.68) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL30259914 0.85 TSHR (0.68) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL5724113 0.84 TSHR (0.72) TSHRSMN1; SMN2TRPV1HPGDP2RX7
Hydrochloric Acid SCHEMBL18130570 0.83 TSHR (0.61) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL4035255 0.83 TSHR (0.65) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL31248395 0.83 TSHR (0.65) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL13683247 0.83 TSHR (0.65) TSHRSMN1; SMN2TRPV1HPGDP2RX7
SCHEMBL7937579 0.81 TSHR (0.63) TSHRSMN1; SMN2TRPV1HPGDP2RX7

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