SCHEMBL10401384

SCHEMBL10401384

CN(C)CCNC(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.62
HTT P42858 4/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
LMNA P02545 2/20 0.62
RECQL P46063 1/20 0.62
MAPT P10636 9/20 0.57
TP53 P04637 3/20 0.57
POLB P06746 1/20 0.57
RAB9A P51151 1/20 0.56
MAPK1 P28482 1/20 0.55
PANK3 Q9H999 1/20 0.55
CA2 P00918 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA9 Q16790 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49

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
SCHEMBL10401849 0.86 CHRM4 (0.54) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL10401770 0.85 CHRM4 (0.57) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL10401922 0.82 MAPT (0.51) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL10401434 0.81 ALDH1A1 (0.50) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL10401523 0.81 ALDH1A1 (0.50) SMN1; SMN2LMNAMAPTTP53CYP1A2
SCHEMBL10401582 0.81 TP53 (0.60) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL3043309 0.81 GFER (0.55) SMN1; SMN2KMT2ALMNAMAPTTP53
SCHEMBL10401512 0.81 GFER (0.58) SMN1; SMN2HTTMEN1KMT2ALMNA
SCHEMBL10401826 0.81 DRD2 (0.62) SMN1; SMN2HTTMEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL10402024 0.80 GFER (0.57) SMN1; SMN2HTTMEN1KMT2ALMNA

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-4960776-A ANTIALLERGENS A. H. ROBINS COMPANY, INC. (US) 1990-10-02 US claimed
EP-0277725-A2 4-Aryl-N-[2-(dialkylamino and heterocyclicamino) alkyl]-1-piperazinecarboxamides and their use as anti allergy agents A.H. ROBINS COMPANY, INCORPORATED (US) 1988-08-10 EP claimed
US-4960776-A ANTIALLERGENS A. H. ROBINS COMPANY, INC. (US) 1990-10-02 US disclosed
EP-0277725-A2 4-Aryl-N-[2-(dialkylamino and heterocyclicamino) alkyl]-1-piperazinecarboxamides and their use as anti allergy agents A.H. ROBINS COMPANY, INCORPORATED (US) 1988-08-10 EP disclosed