SCHEMBL9829153

SCHEMBL9829153

O=C(O)CC(NC(=O)C1CC1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.59
ITGA2B P08514 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
LMNA P02545 1/20 0.55
RECQL P46063 1/20 0.53
F2R P25116 1/20 0.52
F11 P03951 1/20 0.48
CCR5 P51681 1/20 0.48
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
KCNQ3 O43525 1/20 0.47
KCNQ2 O43526 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ITGAV P06756 1/20 0.45

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
SCHEMBL4696193 0.94 SMN1; SMN2 (0.67) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL9830370 0.94 SMN1; SMN2 (0.63) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL4696189 0.94 SMN1; SMN2 (0.67) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL4138087 0.94 SMN1; SMN2 (0.63) ITGB3ITGA2BSMN1; SMN2LMNARECQL
Formic Acid SCHEMBL27557118 0.89 SMN1; SMN2 (0.58) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL14218307 0.87 ITGB3 (0.60) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL3882540 0.87 ITGB3 (0.60) ITGB3ITGA2BSMN1; SMN2LMNARECQL
SCHEMBL4130312 0.82 RECQL (0.62) SMN1; SMN2LMNARECQLCCR5KMT2A
SCHEMBL5424938 0.82 LMNA (0.61) SMN1; SMN2LMNARECQLCCR5KMT2A
Hydrochloric Acid SCHEMBL7290839 0.81 ITGB3 (0.56) ITGB3ITGA2BSMN1; SMN2LMNARECQL

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-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed