SCHEMBL22038686

SCHEMBL22038686

COc1ccc(OCc2c(C)cccc2N(N)C(=O)N(C)N)cc1-c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GYS1 P13807 8/20 0.39
FFAR1 O14842 4/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
PPARD Q03181 1/20 0.38
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
SYK P43405 1/20 0.37
PTGER4 P35408 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL22038754 0.94 FFAR1 (0.41) GYS1FFAR1PPARDSYKPTGER4
SCHEMBL22037243 0.90 FFAR1 (0.41) FFAR1FFAR4PPARD
SCHEMBL22038204 0.84 PARP15 (0.39) FFAR1MEN1KMT2AALDH1A1GAA
SCHEMBL21317993 0.83 PARP15 (0.41) FFAR1MEN1KMT2AALDH1A1
SCHEMBL22038166 0.79 CHRNA7 (0.36) PPARDGAAKDM4E
SCHEMBL22037248 0.78 CD274 (0.42) FFAR1PPARDSYK
SCHEMBL22037225 0.78 MKNK1 (0.42) FFAR1PPARDALDH1A1PTGER4
SCHEMBL17804512 0.77 HTR7 (0.38) FFAR1MEN1KMT2AALDH1A1LMNA
SCHEMBL22038689 0.77 PPARD (0.37) FFAR1MEN1KMT2APPARDALDH1A1
SCHEMBL22038713 0.77 GYS1 (0.39) GYS1FFAR1PPARD

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-2990404-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-05-27 EP disclosed