SCHEMBL9336380

SCHEMBL9336380

C/C(=C\CC(Cl)CO)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9336392 1.00 TP53 (0.32) TP53TSHRTDP1
SCHEMBL4938559 0.83 TP53 (0.32) TP53TSHRTDP1
SCHEMBL8593969 0.83 TP53 (0.32) TP53TSHRTDP1
SCHEMBL5275615 0.78 CD81 (0.31)
SCHEMBL4939027 0.78 GRIK1 (0.32)
SCHEMBL1155612 0.78 CD81 (0.34)
SCHEMBL22491939 0.78
SCHEMBL8624309 0.77 CD81 (0.33)
SCHEMBL3880563 0.77 GRIK1 (0.32) TSHR
SCHEMBL288639 0.77 CD81 (0.33)

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
EP-0371821-B1 A process for the production of substituted acryloyloxyhydroxypropyltrialkylammonium chloride RHONE POULENC SPEC CHIM (US) 1994-05-25 EP disclosed
US-5008444-A Reacting halohydroxypropyl (meth)acrylate with trialkylamine in nonsolvent for quaternary salt POLYPURE, INC. (US) 1991-04-16 US disclosed
EP-0371821-A1 A process for the production of substituted acryloyloxyhydroxypropyltrialkylammonium chloride RHONE-POULENC SPECIALTY CHEMICALS CO. (US) 1990-06-06 EP disclosed