SCHEMBL22038166

SCHEMBL22038166

Cc1cccc(N(N)C(=O)N(C)N)c1COc1cc(-c2ccc(F)cc2)ccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.36
THRB P10828 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MET P08581 1/20 0.34
PPARD Q03181 1/20 0.34
RORC P51449 4/20 0.34
SLC22A12 Q96S37 1/20 0.34
BCL9 O00512 2/20 0.33
CTNNB1 P35222 2/20 0.33
PPARA Q07869 1/20 0.33
MCL1 Q07820 1/20 0.33
CNR2 P34972 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
RORA P35398 1/20 0.33
RORB Q92753 1/20 0.33
MRGPRX4 Q96LA9 3/20 0.32

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
SCHEMBL22038181 0.84 PTGER1 (0.38) THRBSMN1; SMN2SLC22A12KDM4E
SCHEMBL18831746 0.81 SLC22A12 (0.37) THRBSMN1; SMN2SLC22A12MRGPRX4
SCHEMBL22038744 0.80 BRD9 (0.35) THRBSMN1; SMN2RORC
SCHEMBL20686857 0.80 MRGPRX4 (0.47) THRBSMN1; SMN2SLC22A12KDM4EGAA
SCHEMBL22038170 0.80 SMN1; SMN2 (0.41) THRBSMN1; SMN2METSLC22A12MCL1
SCHEMBL22037228 0.79 PPARD (0.39) PPARDPPARA
SCHEMBL22037243 0.79 FFAR1 (0.41) PPARDMCL1
SCHEMBL22038686 0.79 GYS1 (0.39) PPARDKDM4EGAA
SCHEMBL22038762 0.78 MGAM (0.38) THRBSMN1; SMN2METSLC22A12MCL1
SCHEMBL23506215 0.78 MRGPRX4 (0.37) METPPARDSLC22A12MCL1KDM4E

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