SCHEMBL28174282

SCHEMBL28174282

NS(=O)(=O)N1CNc2ccccc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
HSD17B3 P37058 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C1 Q04828 1/20 0.33
TSHR P16473 1/20 0.33
AHR P35869 1/20 0.32
PDK2 Q15119 1/20 0.32
ENPP1 P22413 1/20 0.32

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
SCHEMBL8563581 0.84 BRD4 (0.42) BRD4CREBBPKMT2AMEN1ALOX15
SCHEMBL30885716 0.76 KMT2A (0.50) KMT2AMEN1HSD17B10MAPK1CA1
SCHEMBL7207965 0.73 ALOX15 (0.41) BRD4CREBBPKMT2AMEN1ALOX15
SCHEMBL27827131 0.70 BRD4 (0.42) BRD4CREBBPALOX15HSD17B10MAPK1
SCHEMBL28413210 0.70 MAPK1 (0.47) BRD4CREBBPKMT2AMEN1HSD17B10
SCHEMBL11923135 0.69 BRD4 (0.48) BRD4CREBBPALOX15HSD17B10MAPK1
SCHEMBL19673900 0.69 ALOX15 (0.41) BRD4CREBBPKMT2AMEN1ALOX15
SCHEMBL27738677 0.69 ALDH1A1 (0.41) BRD4KMT2AMEN1HSD17B10MAPK1
SCHEMBL1033548 0.68 KMT2A (0.66) KMT2AMEN1HSD17B10MAPK1L3MBTL1
Indoline SCHEMBL27276532 0.68 PDPK1 (0.46) KMT2AMEN1ALOX15HSD17B10CA1

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-107207467-A 2, 4-dioxo-quinazoline-6-sulfonamide derivatives as inhibitors of PARG 癌症研究科技有限公司 2017-09-26 CN disclosed