SCHEMBL8693202

SCHEMBL8693202

NCC1CCN(CCOc2cccc(Cl)c2)CC1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.74
MAPK1 P28482 1/20 0.74
HTT P42858 1/20 0.74
SMN1; SMN2 Q16637 1/20 0.74
HRH3 Q9Y5N1 8/20 0.65
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
CYP2D6 P10635 1/20 0.64
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 1/20 0.57
TP53 P04637 1/20 0.57
TSHR P16473 1/20 0.57
HTR1A P08908 3/20 0.57
HTR7 P34969 3/20 0.57
DRD2 P14416 1/20 0.55
HTR6 P50406 1/20 0.55
TMEM97 Q5BJF2 1/20 0.52
SIGMAR1 Q99720 1/20 0.52

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
SCHEMBL8692073 0.85 SIGMAR1 (0.68) HRH3KMT2AMEN1ALDH1A1HTR1A
SCHEMBL3571383 0.84 TMEM97 (0.71) HTR1AHTR7TMEM97SIGMAR1
Hydrochloric Acid SCHEMBL8691410 0.83 SIGMAR1 (0.70) HRH3HTR1AHTR7TMEM97SIGMAR1
SCHEMBL8691894 0.83 LMNA (0.68) LMNAMAPK1HTTSMN1; SMN2HRH3
Hydrochloric Acid SCHEMBL8695900 0.83 TMEM97 (0.69) TMEM97SIGMAR1
Hydrochloric Acid SCHEMBL8693016 0.82 KMT2A (0.67) LMNAMAPK1HTTSMN1; SMN2HRH3
SCHEMBL14970675 0.81 SMN1; SMN2 (0.85) LMNAMAPK1HTTSMN1; SMN2HRH3
SCHEMBL8690694 0.81 LMNA (0.65) LMNAMAPK1HTTSMN1; SMN2HRH3
SCHEMBL8788847 0.81 LMNA (0.68) LMNAMAPK1HTTSMN1; SMN2HRH3
Hydrochloric Acid SCHEMBL8691261 0.80 KMT2A (0.64) LMNAMAPK1HTTSMN1; SMN2HRH3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760035-A PIPERIDINE COMPOUNDS SUBSTITUTED WITH AN AMINOALKYL GROUP AND AN ARYLOXYALKYL GROUP, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS KNOLL AKTIENGESELLSCHAFT (DE) 1998-06-02 US disclosed
EP-0720602-B1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1997-07-09 EP disclosed
EP-0720602-A1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1996-07-10 EP disclosed
WO-1995008535-A1 4-ALKYLAMINO-1-PHENOXYALKYL PIPERIDINES AS ANTIINFLAMMATORY, ANTIALLERGIC AND IMMUNOMODULATING AGENTS KNOLL AG (DE) 1995-03-30 WO disclosed