SCHEMBL7676950

SCHEMBL7676950

O=C(NC[C@H](C(=O)O)c1ccccc1)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HTT P42858 1/20 0.52
CTSS P25774 3/20 0.50
CTSL P07711 2/20 0.50
SLC1A3 P43003 1/20 0.50
SLC1A1 P43005 1/20 0.50
HSD17B10 Q99714 1/20 0.48
CTSK P43235 3/20 0.48
SYK P43405 1/20 0.48
CTSB P07858 1/20 0.48
ATM Q13315 1/20 0.48
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TP53 P04637 1/20 0.47
GFER P55789 1/20 0.47
CASP1 P29466 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL6962684 1.00 LMNA (0.55) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL7676954 1.00 LMNA (0.55) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL17825637 0.90 LMNA (0.49) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL24736141 0.88 LMNA (0.52) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL17825663 0.87 CNR2 (0.47) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL7310621 0.86 HSD17B10 (0.59) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL28088132 0.85 SLC1A3 (0.61) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL7448245 0.85 CTSS (0.47) LMNASMN1; SMN2HTTCTSSCTSL
SCHEMBL28491869 0.83 SMN1; SMN2 (0.51) LMNASMN1; SMN2HTTHSD17B10ATM
SCHEMBL13569333 0.83 SMN1; SMN2 (0.62) LMNASMN1; SMN2HTTCTSSCTSL

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
US-6417203-B1 HETEROCYCLIC AMIDES PFIZER INC. 2002-07-09 US disclosed