SCHEMBL8975974

SCHEMBL8975974

CCNCC(CCS)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
FOLH1 Q04609 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.31
ANPEP P15144 1/20 0.31
ENPEP Q07075 1/20 0.31

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
SCHEMBL8976208 0.80 CA1 (0.36) CA1CA2FOLH1ANPEPENPEP
SCHEMBL28140665 0.79 CA2 (0.48) CA1CA2MEN1LMNAMAPT
SCHEMBL8976516 0.71 CA1 (0.35) CA1CA2FOLH1ANPEPENPEP
SCHEMBL8975857 0.69 HTT (0.38) CA1CA2FOLH1MEN1LMNA
SCHEMBL8976076 0.69 SLC1A3 (0.41) CA1CA2FOLH1ANPEPENPEP
SCHEMBL9443557 0.69 CA2 (0.57) CA1CA2MAPTMAPK1
SCHEMBL5500834 0.69 FOLH1 (0.40) CA1CA2FOLH1ANPEPENPEP
SCHEMBL8975813 0.68 MMP3 (0.33) CA1CA2ANPEPENPEP
SCHEMBL2874733 0.67 TSHR (0.43) CA1CA2FOLH1KMT2A
SCHEMBL17885438 0.66 CA2 (0.56) CA1CA2MEN1LMNAMAPT

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-0514282-B1 Alkylamino mercaptoalkylamides or salts thereof acceptable for cosmetic use, their use as a reducing agent and a process for the permanent deformation of hair OREAL (FR) 1996-04-10 EP claimed