SCHEMBL19984304

SCHEMBL19984304

Cc1ccc(Nc2ccc3c(C(=O)N(C)C)c[nH]c3c2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.38
STING1 Q86WV6 3/20 0.36
HAT1 O14929 4/20 0.35
EP300 Q09472 4/20 0.35
MAPK14 Q16539 1/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
CFTR P13569 3/20 0.33
DHODH Q02127 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
IMPDH2 P12268 1/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL19984228 0.80 NR4A2 (0.46) NR4A2HAT1EP300MAPK14DHODH
SCHEMBL19983947 0.80 TUBB1 (0.48) NR4A2MAPK14TUBB1NPC1RAB9A
SCHEMBL19983975 0.78 ALK (0.40) NR4A2HAT1EP300MAPK14
SCHEMBL19983834 0.74 PRKAG1 (0.42) NR4A2TUBB1IMPDH2RAB9A
SCHEMBL19983934 0.74 TUBB1 (0.41) NR4A2STING1IDO1TDO2TUBB1
SCHEMBL19983751 0.74 GPR84 (0.40) STING1CFTR
SCHEMBL7847121 0.70 CDK4 (0.46) HAT1EP300TDO2TUBB1NPC1
SCHEMBL30762247 0.69 ALDH1A1 (0.51) NR4A2TUBB1IMPDH2
SCHEMBL15651984 0.67 NR4A2 (0.41) NR4A2HAT1EP300TUBB1
SCHEMBL207031 0.66 KDM4E (0.57) NPC1

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-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed