SCHEMBL31455608

SCHEMBL31455608

C=Cc1ccc(C(=O)OC)cc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.57
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.50
HTT P42858 3/20 0.50
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
P4HB P07237 1/20 0.48
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
XDH P47989 1/20 0.44
ALOX15 P16050 2/20 0.42
CYP3A4 P08684 1/20 0.41
ESRRA P11474 1/20 0.41
PDK2 Q15119 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 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
SCHEMBL3903479 1.00 NOTUM (0.57) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL24214174 0.88 NOTUM (0.61) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL17978937 0.86 NOTUM (0.59) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL16094381 0.81 SMN1; SMN2 (0.45) KDM4EL3MBTL1P4HBCA12CA1
SCHEMBL1997248 0.80 NOTUM (0.73) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL4129101 0.80 CA1 (0.47) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL10907300 0.79 NOTUM (0.66) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL10861732 0.78 NOTUM (0.64) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL321308 0.78 NOTUM (0.79) NOTUMKDM4EALDH1A1HTTLMNA
SCHEMBL879847 0.78 ALDH1A1 (0.49) NOTUMKDM4EALDH1A1HTTLMNA

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
WO-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed