SCHEMBL11484372

SCHEMBL11484372

Cc1ccn(C(O)C(C)C)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
NOS1 P29475 1/20 0.38
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9900046 0.83
SCHEMBL31030360 0.79 LMNA (0.41) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL31030307 0.79 LMNA (0.41) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL31030338 0.79 LMNA (0.41) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL31030400 0.79 LMNA (0.41) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL12862654 0.78 LMNA (0.40) LMNANOS1MAPTRAB9AKDM4E
Ammonia Solution, Strong SCHEMBL29168174 0.76 LMNA (0.41) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL2462529 0.75 MAPT (0.40) LMNANOS1MAPTRAB9AKDM4E
SCHEMBL30320144 0.75
SCHEMBL22170028 0.74

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-0008056-A1 N-substituted pyrazole derivatives, process for their preparation and N-hydroxyalkylpyrazoles obtained in the course of this process BAYER AG (DE) 1980-02-20 EP disclosed