SCHEMBL9863251

SCHEMBL9863251

Cc1ccc(Cl)c(Nc2ccccc2C2=NNCO2)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 3/20 0.55
PTGS2 P35354 7/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 2/20 0.46
KMT2A Q03164 2/20 0.46
METTL3 Q86U44 2/20 0.46
AKR1B10 O60218 1/20 0.46
ABCB11 O95342 1/20 0.46
TTR P02766 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
CHRM1 P11229 1/20 0.46
FABP2 P12104 1/20 0.46
RXRA P19793 1/20 0.46
TBXA2R P21731 1/20 0.46
NR4A1 P22736 1/20 0.46
PTGS1 P23219 1/20 0.46
PDE4A P27815 1/20 0.46
AKR1C3 P42330 1/20 0.46
NR4A2 P43354 1/20 0.46
AKR1C2 P52895 1/20 0.46

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
SCHEMBL9682977 0.71 FTO (0.61) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL2760397 0.71 PTGS2 (0.65) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL24021595 0.71 CLCN2 (0.63) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL9265268 0.71 CLCN2 (0.57) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL7902075 0.71 CLCN2 (0.57) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL9260755 0.71 CLCN2 (0.57) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL9260616 0.71 CLCN2 (0.57) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL9683614 0.71 PTGS2 (0.51) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL9264707 0.70 CLCN2 (0.56) CLCN2PTGS2MEN1MAPK1KMT2A
SCHEMBL7916355 0.70 CLCN2 (0.56) CLCN2PTGS2MEN1MAPK1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3074375-A None JP disclosed
JP-H0374375-A FENAMATE 1,3,4-THIADIAZOLE AND 1,3,4-OXADIAZOLE AS ANTIINFLAMMATORY AGENT WARNER LAMBERT CO 1991-03-28 JP disclosed