SCHEMBL19984228

SCHEMBL19984228

Cc1ccc(Nc2ccc3c(C(=O)N(C)C)c[nH]c3c2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.46
BCL6 P41182 3/20 0.41
BCOR Q6W2J9 3/20 0.41
PRKAB2 O43741 1/20 0.40
PRKAG1 P54619 1/20 0.40
PRKAA2 P54646 1/20 0.40
PRKAA1 Q13131 1/20 0.40
PRKAG3 Q9UGI9 1/20 0.40
PRKAG2 Q9UGJ0 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40
POLB P06746 1/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 1/20 0.38
HAT1 O14929 1/20 0.38
EP300 Q09472 1/20 0.38
MAPK8 P45983 5/20 0.37
MAPK10 P53779 5/20 0.37
MAPK14 Q16539 5/20 0.37
NPC1 O15118 1/20 0.37
CASP3 P42574 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
SCHEMBL19983975 0.83 ALK (0.40) NR4A2BCL6BCORHAT1EP300
SCHEMBL19984304 0.80 NR4A2 (0.38) NR4A2RAB9AHAT1EP300MAPK14
SCHEMBL19983988 0.80 POLB (0.38) NR4A2BCL6BCORPOLBMAPK8
SCHEMBL19983834 0.78 PRKAG1 (0.42) NR4A2BCL6BCORPRKAB2PRKAG1
SCHEMBL19983947 0.75 TUBB1 (0.48) NR4A2PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19983715 0.74 HTR2A (0.42) BCL6BCORMAPK8MAPK10MAPK14
SCHEMBL22864436 0.72 NR4A2 (0.63) NR4A2RAB9ALMNA
SCHEMBL19983934 0.72 TUBB1 (0.41) NR4A2
SCHEMBL30762247 0.71 ALDH1A1 (0.51) NR4A2
SCHEMBL10322039 0.70 NR4A2 (0.60) NR4A2PRKAB2PRKAG1PRKAA2PRKAA1

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