SCHEMBL7773013

SCHEMBL7773013

COC(=O)C=NS(=O)(=O)c1ccc(C)cc1.O=C(O)C=NS(=O)(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
ALDH1A1 P00352 8/20 0.44
LMNA P02545 5/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
PPARG P37231 1/20 0.41
MEN1 O00255 2/20 0.40
HPGD P15428 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL7773010 1.00 F2 (0.44) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8601200 0.90 F2 (0.53) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8601203 0.90 F2 (0.53) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8575541 0.81 ALDH1A1 (0.45) ALDH1A1LMNAKMT2AKDM4EMAPT
SCHEMBL8575539 0.81 ALDH1A1 (0.45) ALDH1A1LMNAKMT2AKDM4EMAPT
SCHEMBL15705594 0.76 LMNA (0.49) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL12871278 0.76 LMNA (0.49) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL15652592 0.72 F2 (0.59) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL15652594 0.72 F2 (0.59) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL11075418 0.70 SMN1; SMN2 (0.45) F2PRSS1PRSS2PRSS3ALDH1A1

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
EP-0775192-B1 BLEACHING COMPOSITIONS CONTAINING IMINE, PEROXIDE COMPOUND AND A TRANSITION METAL CATALYST UNILEVER NV (NL) 2001-08-01 EP disclosed