SCHEMBL902178

SCHEMBL902178

C=CC(=O)NC(CC)N(C)C.CCCS(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
ENPEP Q07075 4/20 0.30

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
SCHEMBL424692 0.86 TSHR (0.48) TSHRZDHHC20ZDHHC2
Hydrochloric Acid SCHEMBL5487753 0.84 TSHR (0.47) TSHRZDHHC20ZDHHC2
SCHEMBL28007122 0.84 TSHR (0.42) TSHRZDHHC20ZDHHC2ENPEP
SCHEMBL28330061 0.80 TSHR (0.42) TSHRZDHHC20ZDHHC2
SCHEMBL26105139 0.79 TGFBR1 (0.38) ENPEP
SCHEMBL28390981 0.79 TSHR (0.39) TSHRZDHHC20ZDHHC2ENPEP
SCHEMBL7629624 0.78 TSHR (0.41) TSHRZDHHC20ZDHHC2
SCHEMBL29175678 0.77 ZDHHC20 (0.43) TSHRZDHHC20ZDHHC2
SCHEMBL5923621 0.77 ZDHHC20 (0.43) TSHRZDHHC20ZDHHC2
SCHEMBL7712238 0.76 TSHR (0.45) TSHRZDHHC20ZDHHC2

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
WO-2023072990-A1 LONG-LASTING DISINFECTING COMPOSITIONS AND METHODS FOR LONG-LASTING DISINFECTION RHODIA OPERATIONS (FR) 2023-05-04 WO disclosed
WO-2012042157-A1 GEL PROCESS FOR POLYMERIZATION VIA ULTRASOUND INITIATION UPPA - UNIVERSITÉ DE PAU ET DES PAYS DE L'ADOUR (FR) 2012-04-05 WO disclosed