SCHEMBL6929888

SCHEMBL6929888

CCN(CC)C(=O)Cc1nsc(NS(=O)(=O)c2c(C)cc(Cl)cc2Cl)n1.CCN(CC)C(=O)Cc1nsc(NS(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.43
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43
CRHR1 P34998 3/20 0.38
TSPO P30536 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 2/20 0.35
PFKFB3 Q16875 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL5831380 0.99 HSD11B1 (0.43) HSD11B1HSD17B1HSD17B2CRHR1TSPO
SCHEMBL5830977 0.95 HSD11B1 (0.44) HSD11B1HSD17B1HSD17B2CRHR1TSPO
SCHEMBL5831130 0.90 HSD11B1 (0.37) HSD11B1HSD17B1HSD17B2CRHR1NPC1
SCHEMBL5830489 0.87 HSD11B1 (0.38) HSD11B1NPC1RAB9AKMT2AMEN1
SCHEMBL5831702 0.85 HSD11B1 (0.41) HSD11B1HSD17B1HSD17B2CRHR1NPC1
SCHEMBL5830785 0.82 HSD11B1 (0.42) HSD11B1NPC1RAB9AKMT2AMEN1
SCHEMBL3621399 0.82 HSD11B1 (0.64) HSD11B1HSD17B1HSD17B2KMT2AMEN1
SCHEMBL6929895 0.81 CRHR1 (0.37) HSD11B1HSD17B1HSD17B2CRHR1KMT2A
SCHEMBL5831400 0.81 KMT2A (0.42) HSD11B1HSD17B1HSD17B2CRHR1KMT2A
SCHEMBL3248368 0.80 HSD11B1 (0.41) HSD11B1HSD17B1HSD17B2CRHR1TSPO

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
WO-2004113310-A1 USE OF AN INHIBITOR OF 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE 1 COMPOUNDS FOR PROMOTING WOUND HEALING BIOVITRUM AB (SE) 2004-12-29 WO disclosed