SCHEMBL5034972

SCHEMBL5034972

CCC(C(N)=O)N(C)CC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
TDP1 Q9NUW8 1/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 1/20 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
SCHEMBL1432655 0.84 CA1 (0.30) CA1CA2TDP1
SCHEMBL17772988 0.80 GABRR1 (0.32) TDP1
SCHEMBL19432853 0.80
SCHEMBL572461 0.80
SCHEMBL8976186 0.79 ANPEP (0.31) CA1CA2
SCHEMBL25657495 0.78 CHRM1 (0.33) CA2TDP1USP2TSHR
SCHEMBL19286939 0.78 CA1 (0.37) CA1CA2
SCHEMBL11890791 0.78 USP2 (0.31) TDP1USP2TSHR
SCHEMBL24072255 0.76 CA1 (0.33) CA1CA2
SCHEMBL22215230 0.74 CA1 (0.34) CA1CA2TDP1

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
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP claimed
US-9968589-B2 Method of treating disease by auricular anesthesia of cranial nerves CREWS THOMAS M (US) 2018-05-15 US disclosed