SCHEMBL9413855

SCHEMBL9413855

Cc1nn2c(=S)nc(N)cc2n1CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.34
AKR1B10 O60218 2/20 0.31
PTGDR2 Q9Y5Y4 2/20 0.31
KDM4E B2RXH2 4/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL9413794 0.86 LMNA (0.30) LMNA
SCHEMBL9413772 0.73 CDK9 (0.33)
SCHEMBL9413883 0.72 CSNK2A2 (0.33) KDM4EALDH1A1
SCHEMBL9413917 0.70 TSHR (0.32) AKR1B10
SCHEMBL9413835 0.68 KMT2A (0.33) KDM4EALDH1A1
SCHEMBL9413841 0.63 NOS2 (0.31)
SCHEMBL9413839 0.62 PTGS2 (0.33) KDM4EHSD17B10ALDH1A1
SCHEMBL9409258 0.61 KMT2A (0.45) LMNAKDM4EALDH1A1
SCHEMBL9413872 0.61
SCHEMBL19086956 0.60 LMNA (0.68) LMNAGAAKDM4EALDH1A1

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-0582261-A1 Cephalosporin compounds and processes for the preparation thereof LUCKY LTD. (KR) 1994-02-09 EP disclosed