SCHEMBL7303500

SCHEMBL7303500

CN(CC(O)c1ccc(F)cc1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.53
IGF1R P08069 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 9/20 0.47
ALDH1A1 P00352 5/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
HTR1A P08908 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ENPP2 Q13822 1/20 0.44
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SIRT6 Q8N6T7 1/20 0.41

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
SCHEMBL7302491 0.95 IGF1R (0.53) POLBIGF1RMEN1KMT2AMAPT
SCHEMBL9309161 0.84 KDM4E (0.47) IGF1RMEN1KMT2AMAPTLMNA
SCHEMBL9451695 0.81 POLB (0.59) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL10036175 0.76 MAPT (0.53) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL9451699 0.75 SIRT6 (0.51) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL15372693 0.74 MAPT (0.54) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL3440216 0.74 MAPT (0.59) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL7319744 0.73 KDM4E (0.48) MEN1KMT2ALMNAKDM4E
SCHEMBL9451638 0.73 SIGMAR1 (0.51) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL12005574 0.72 POLB (1.00) POLBMEN1KMT2AMAPTALDH1A1

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
EP-0503411-B1 Substituted N-phenylpiperidines and medicaments thereof BASF AG (DE) 1995-11-29 EP disclosed
US-5296485-A Substituted N-phenylpiperidines and drugs therefrom BASF AKTIENGESELLSCHAFT (DE) 1994-03-22 US disclosed