SCHEMBL10834633

SCHEMBL10834633

Cc1cc(C)nc(NS(=O)(=O)c2ccc(/N=N/c3ccc(O)c(CCC(=O)O)c3)cc2)n1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 2/20 0.60
KDR P35968 1/20 0.59
LMNA P02545 1/20 0.50
TSHR P16473 1/20 0.50
GAA P10253 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
BRD4 O60885 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL10834640 1.00 AMY1A (0.60) AMY1AKDRLMNATSHRGAA
SCHEMBL10834896 0.90 AMY1A (0.61) AMY1AKDRLMNATSHRGAA
SCHEMBL10834904 0.90 AMY1A (0.61) AMY1AKDRLMNATSHRGAA
Salazosulfadimidine SCHEMBL150333 0.84 AMY1A (0.63) AMY1AKDRLMNATSHRGAA
Salazosulfadimidine SCHEMBL31424085 0.84 AMY1A (0.63) AMY1AKDRLMNATSHRGAA
SCHEMBL10834749 0.83 HSD11B1 (0.48) AMY1AKDRLMNATSHRALDH1A1
SCHEMBL10834754 0.83 HSD11B1 (0.48) AMY1AKDRLMNATSHRALDH1A1
SCHEMBL10834732 0.79 BRD4 (0.72) LMNATSHRALDH1A1MEN1KMT2A
SCHEMBL10834737 0.79 BRD4 (0.72) LMNATSHRALDH1A1MEN1KMT2A
SCHEMBL10834891 0.76 MAPT (0.49) KDRLMNAGAAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4628083-A ANTIFERTILITY ENZYME INHIBITOR, PROSTAGLANDIN INFLUENCE PHARMACIA AB (SE) 1986-12-09 US disclosed
EP-0021229-B1 ARYLAZO COMPOUNDS, THEIR PREPARATION AND THEIR USE PHARMACIA AB (SE) 1982-12-22 EP disclosed
EP-0021229-A1 Arylazo compounds, their preparation and their use PHARMACIA AB (SE) 1981-01-07 EP disclosed