SCHEMBL19987602

SCHEMBL19987602

Cc1cc(-c2nn(C)c(Cl)c2C=O)ccc1OCc1ccccc1N(C)N

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 3/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
ACLY P53396 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 5/20 0.31
CYP2C19 P33261 4/20 0.31
HPGD P15428 4/20 0.31
MAPT P10636 3/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
CYP2C9 P11712 3/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2C8 P10632 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30

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
SCHEMBL16273669 0.80 FFAR1 (0.32) CD274FFAR1FFAR4ACLYALDH1A1
SCHEMBL16627900 0.79 ALDH1A1 (0.40) ACLYALDH1A1LMNACYP1A2CYP2C19
SCHEMBL19987551 0.79 CD274 (0.39) CD274FFAR1FFAR4MRGPRX4S1PR1
SCHEMBL19987537 0.76 KDM4E (0.33) CD274ALDH1A1LMNACYP1A2HPGD
SCHEMBL16627158 0.76 ACLY (0.43) ACLYCYP1A2CYP2C19HPGDMAPT
SCHEMBL18831709 0.74 NR1H4 (0.32) CD274MRGPRX4
SCHEMBL18831194 0.73 EPHA2 (0.34) ACLYCYP1A2CYP2C19MAPTCYP3A4
SCHEMBL16627217 0.73 MAPT (0.39) ACLYALDH1A1CYP1A2CYP2C19HPGD
SCHEMBL18831303 0.72 CD274 (0.33) CD274ALDH1A1CYP1A2CYP2C19HPGD
SCHEMBL16910994 0.72 NR1H4 (0.32) CYP1A2CYP2C19HPGDMAPTMEN1

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-3006440-B1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL CO (JP) 2018-03-21 EP disclosed