SCHEMBL31487397

SCHEMBL31487397

COc1cc([N+](=O)[O-])c(F)cc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
ALDH1A1 P00352 6/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
GPR174 Q9BXC1 4/20 0.47
CCNT1 O60563 1/20 0.47
CDK9 P50750 1/20 0.47
GAA P10253 1/20 0.44
MET P08581 1/20 0.44
KDM4E B2RXH2 1/20 0.44
KCNH2 Q12809 1/20 0.43
RECQL P46063 1/20 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
SCHEMBL30965662 1.00 MAPT (0.52) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL521293 0.89 MAPT (0.63) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL30258446 0.89 MAPT (0.63) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL521504 0.88 MAPT (0.59) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL24847590 0.81 BACE1 (0.45) MAPTALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL30179902 0.81 BACE1 (0.45) MAPTALDH1A1LMNASMN1; SMN2KCNH2
SCHEMBL30965619 0.81 SMARCA2 (0.47) MAPTALDH1A1LMNAMEN1CYP1A2
SCHEMBL2204635 0.81 MAPT (0.53) MAPTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL2873860 0.80 MAPT (0.55) MAPTALDH1A1LMNASMN1; SMN2GPR174
SCHEMBL22858566 0.80 MAPT (0.52) MAPTALDH1A1LMNASMN1; SMN2MEN1

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
CN-119790057-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2025-04-08 CN disclosed