SCHEMBL7944349

SCHEMBL7944349

CC(NC(CS)C(=O)O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.56
MME P08473 8/20 0.51
CASR P41180 1/20 0.46
ACP3 P15309 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL9752562 1.00 APAF1 (0.56) APAF1MMECASRACP3MEN1
SCHEMBL7620487 1.00 APAF1 (0.56) APAF1MMECASRACP3MEN1
Hydrochloric Acid SCHEMBL27713537 0.98 APAF1 (0.54) APAF1MMECASRACP3MEN1
SCHEMBL27505417 0.87 APAF1 (0.53) APAF1MMECASRACP3MEN1
SCHEMBL652495 0.84 MEN1 (0.56) APAF1MMECASRACP3MEN1
SCHEMBL17530041 0.83 MMP9 (0.55) APAF1MME
SCHEMBL18722285 0.83 MMP9 (0.55) APAF1MME
SCHEMBL17530042 0.83 MMP9 (0.55) APAF1MME
SCHEMBL11774297 0.83 APAF1 (0.51) APAF1CASRACP3MEN1KMT2A
SCHEMBL14935643 0.82 MME (0.47) APAF1MMEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017070157-A1 REDOX DEHYDRATION COUPLING CATALYSTS AND METHODS RELATED THERETO EMORY UNIVERSITY (US) 2017-04-27 WO disclosed
WO-2015054337-A1 HETEROCYCLIC COUPLING CATALYSTS AND METHODS RELATED THERETO EMORY UNIVERSITY (US) 2015-04-16 WO disclosed
CN-1196686-C Method for storing quaternary ammonium salt TOKUYAMA CORP (JP) 2005-04-13 CN disclosed
CN-1372554-A Method for preserving quaternary ammonium salts TOKUYAMA CORP (JP) 2002-10-02 CN disclosed
US-6322964-B1 PEPTIDE FOR USE AS A DIAGNOSTIC TOOL IN DETECTION OF PREFERENTIAL VIRAL DISEASE GENETIC SYSTEMS CORPORATION 2001-11-27 US disclosed
EP-0284383-B2 Synthetic antigens for the detection of aids-related disease caused by LAV-2 GENETIC SYSTEMS CORP (US) 2000-04-05 EP disclosed
US-5166050-A Monoclonal antibodies and peptides useful in treating and diagnosing HIV infections BRISTOL-MYERS SQUIBB COMPANY (US) 1992-11-24 US disclosed
WO-1989009782-A1 NEW ANTI-RECEPTOR PEPTIDES AND THERAPEUTIC AGENTS UNITED STATES OF AMERICA, REPRESENTED BY THE SECRE (US) 1989-10-19 WO disclosed
EP-0284383-A1 Synthetic antigens for the detection of aids-related disease caused by LAV-2 GENETIC SYSTEMS CORPORATION (US) 1988-09-28 EP disclosed