SCHEMBL7175079

SCHEMBL7175079

CCCCc1csc(NS(=O)(=O)c2cccc(Cl)c2S(C)(=O)=O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.52
▸ HSD17B1 P14061 2/20 0.52
▸ HSD17B2 P37059 2/20 0.52
▸ ADRB2 P07550 1/20 0.45
▸ ADRB1 P08588 1/20 0.45
▸ ADRB3 P13945 1/20 0.45
▸ KMT2A Q03164 4/20 0.43
▸ KDM1A O60341 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ MAOA P21397 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ CTPS1 P17812 5/20 0.41
▸ CYP2C19 P33261 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL5911760 0.87 HSD11B1 (0.67) HSD11B1HSD17B1HSD17B2ADRB2ADRB1
SCHEMBL7137179 0.84 HSD11B1 (0.58) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL7166097 0.81 HSD11B1 (0.57) HSD11B1HSD17B1HSD17B2KMT2AMEN1
SCHEMBL7146931 0.81 HSD11B1 (0.46) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL5911680 0.80 HSD11B1 (0.69) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL3622383 0.77 HSD11B1 (0.66) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL20899769 0.77 HSD11B1 (0.62) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL3620379 0.77 HSD11B1 (0.60) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL4968140 0.77 HSD11B1 (0.64) HSD11B1HSD17B1HSD17B2KMT2AKDM1A
SCHEMBL3602689 0.76 HSD11B1 (0.66) HSD11B1HSD17B1HSD17B2KMT2AKDM1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1283833-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-02-19 — — EP disclosed
WO-2001090091-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 — — WO disclosed
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