SCHEMBL9821188

SCHEMBL9821188

NC(=O)CNC(=O)CN1CC(c2ccccc2)CC1=O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.67
LMNA P02545 2/20 0.62
SMN1; SMN2 Q16637 4/20 0.56
TSHR P16473 2/20 0.54
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.52
KDM4E B2RXH2 3/20 0.50
HTT P42858 3/20 0.50
MAPT P10636 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.46
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
CHRM5 P08912 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
POLB P06746 1/20 0.44
CYP2C19 P33261 1/20 0.44
BRD4 O60885 3/20 0.43

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
SCHEMBL563022 0.85 TP53 (0.67) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL1906215 0.85 TP53 (0.67) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL3155232 0.85 TP53 (0.67) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL32688308 0.84 TP53 (0.74) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL20573309 0.84 TP53 (0.74) TP53LMNASMN1; SMN2TSHRALDH1A1
Hydrochloric Acid SCHEMBL32688148 0.84 TP53 (0.65) TP53LMNASMN1; SMN2TSHRALDH1A1
Hydrochloric Acid SCHEMBL32688158 0.84 TP53 (0.65) TP53LMNASMN1; SMN2TSHRALDH1A1
Hydrochloric Acid SCHEMBL32688612 0.83 TP53 (0.72) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL11513286 0.82 LMNA (0.66) TP53LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL11115844 0.80 TP53 (0.44) TP53LMNASMN1; SMN2TSHRALDH1A1

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
US-5021568-A Lactam-1-acetic acid carbalkoxymethyl esters and method for preparing same SHIPOV ALEXANDR G (SU) 1991-06-04 US disclosed
US-4162325-A PHARMACEUTICAL ACTIVITY ON THE MNEMIC PROCESSES UCB, SOCIETE ANONYME (BE) 1979-07-24 US disclosed