SCHEMBL29449333

SCHEMBL29449333

COc1ccc(Oc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TBXA2R P21731 1/20 0.40
CA2 P00918 5/20 0.39
CA1 P00915 4/20 0.39
CA9 Q16790 4/20 0.39
CA12 O43570 2/20 0.39
PTGS2 P35354 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TLR8 Q9NR97 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
NFE2L2 Q16236 1/20 0.37

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
SCHEMBL30856840 0.75 EPAS1 (0.56)
SCHEMBL16555485 0.75 EPAS1 (0.56)
SCHEMBL29155750 0.74 ALDH1A1 (0.40) NPY1RKMT2ACA2CA1CA9
SCHEMBL22588264 0.73 ALDH1A1 (0.53) RAB9AKMT2ASMN1; SMN2TBXA2RPTGS2
SCHEMBL29449330 0.72 MERTK (0.47) SMN1; SMN2TBXA2RCA2CA1CA9
SCHEMBL28720565 0.72 MERTK (0.47) SMN1; SMN2TBXA2RCA2CA1CA9
SCHEMBL23175141 0.71 ALDH1A1 (0.62) NPY1RKMT2ASMN1; SMN2CA2CA1
SCHEMBL10817391 0.70 L3MBTL1 (0.59) NPC1RAB9AKMT2ASMN1; SMN2CA2
SCHEMBL16376159 0.70 TBXA2R (0.52) NPC1RAB9AKMT2ASMN1; SMN2TBXA2R
SCHEMBL31286145 0.70 CA2 (0.46) KMT2ACA2CA1CA9CA12

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
CN-111961005-B Phenyl uracil compound and application thereof 南北兄弟药业投资有限公司 2022-04-12 CN disclosed