SCHEMBL7344790

SCHEMBL7344790

O=C(O)CCN1CCNCC1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
MAPK1 P28482 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
POLB P06746 2/20 0.43
HSD17B10 Q99714 1/20 0.42
CXCR4 P61073 2/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM3 P20309 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL905223 1.00 GLA (0.55) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL7508214 0.98 GLA (0.53) GLASMN1; SMN2CYP1A2MAPK1ITGB3
Hydrochloric Acid SCHEMBL28282429 0.98 GLA (0.59) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL7528972 0.98 GLA (0.53) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL8795424 0.98 GLA (0.53) GLASMN1; SMN2CYP1A2MAPK1ITGB3
Aziridine SCHEMBL28507214 0.93 GLA (0.57) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL3193772 0.89 GLA (0.46) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL6371114 0.89 CXCR4 (0.61) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL9059317 0.89 CXCR4 (0.52) GLASMN1; SMN2CYP1A2MAPK1ITGB3
SCHEMBL28386664 0.87 GLA (0.44) GLASMN1; SMN2CYP1A2MAPK1ITGB3

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-5446037-A Antiallergens; elastase inhibitors SYNPHAR LABORATORIES, INC. (CA) 1995-08-29 US disclosed