SCHEMBL10778237

SCHEMBL10778237

Cc1ccc(S(=O)(=O)Nc2cc(Br)c(N)c3c2C(=O)c2c(NS(=O)(=O)c4ccc(C)cc4)cc(Oc4ccccc4)c(N)c2C3=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 7/20 0.54
BRPF1 P55201 7/20 0.54
BRD1 O95696 6/20 0.54
CDK2 P24941 1/20 0.50
CYP2C9 P11712 3/20 0.48
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 1/20 0.48
FFAR1 O14842 1/20 0.48
MRGPRX1 Q96LB2 1/20 0.44
LMNA P02545 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
NOD2 Q9HC29 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
CA12 O43570 2/20 0.41
CA2 P00918 2/20 0.41

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
SCHEMBL10777401 1.00 TRIM24 (0.54) TRIM24BRPF1BRD1CDK2CYP2C9
SCHEMBL10780380 0.94 TRIM24 (0.60) TRIM24BRPF1BRD1CDK2CYP2C9
SCHEMBL10782037 0.94 TRIM24 (0.60) TRIM24BRPF1BRD1CDK2CYP2C9
SCHEMBL10780530 0.89 CDK2 (0.44) TRIM24BRPF1BRD1CDK2CYP2C9
SCHEMBL11599593 0.88 CDK2 (0.64) TRIM24BRPF1BRD1CDK2CYP2C9
SCHEMBL10778264 0.85 CDK2 (0.57) CDK2CYP2C9CYP2C19LMNAL3MBTL1
SCHEMBL10487975 0.85 CDK2 (0.57) CDK2CYP2C9CYP2C19LMNAL3MBTL1
SCHEMBL10603963 0.85 P2RY4 (0.47) TRIM24BRPF1BRD1CDK2
SCHEMBL11212573 0.85 P2RY4 (0.47) TRIM24BRPF1BRD1CDK2
SCHEMBL10488155 0.85 CDK2 (0.55) TRIM24BRPF1BRD1CDK2CYP2C9

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
US-4689171-A LIQUID CRYSTALS BAYER AKTIENGESELLSCHAFT (DE) 1987-08-25 US disclosed