SCHEMBL2129234

SCHEMBL2129234

COC(=O)Oc1cc(-c2ccc(C)cc2)c2nccn2c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.43
HDAC6 Q9UBN7 1/20 0.41
CYP1A2 P05177 3/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 3/20 0.41
SPTLC1 O15269 1/20 0.39
XDH P47989 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
SYK P43405 6/20 0.38
TMIGD3 P0DMS9 2/20 0.36
AURKA O14965 1/20 0.35
CD63 P08962 1/20 0.35
EPHB4 P54760 1/20 0.35
CYP46A1 Q9Y6A2 1/20 0.34

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
SCHEMBL454081 0.76 SPTLC1 (0.53) TNKSHDAC6SPTLC1XDHSLC22A12
SCHEMBL3025899 0.72 ALDH1A3 (0.39) TNKSSPTLC1XDHSLC22A12SYK
SCHEMBL4966520 0.70 TRIM33 (0.43) CYP1A2SYK
SCHEMBL9788686 0.69 TNKS (0.46) TNKSHDAC6CYP1A2CYP3A4CYP2C9
SCHEMBL14205190 0.68 LMNA (0.55)
SCHEMBL2128509 0.68 ALDH1A1 (0.64)
SCHEMBL5343582 0.68 SPTLC1 (0.45) SPTLC1XDHSLC22A12
SCHEMBL17066644 0.67 BCHE (0.49) CYP1A2CYP3A4CYP2C9
SCHEMBL20125121 0.67 ACKR3 (0.43) TNKSSPTLC1XDHSLC22A12TMIGD3
SCHEMBL1431759 0.66 TNKS (0.47) TNKSSYK

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
EP-2129375-B1 IMIDAZO[1,2-A]PYRIDINES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2012-04-25 EP claimed