SCHEMBL3376436

SCHEMBL3376436

CN(CC1CC(Oc2cccc(Cl)c2CN2CCCC2)C1)C(=O)Nc1ccccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HRH3 Q9Y5N1 1/20 0.42
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HSD17B10 Q99714 2/20 0.41
GAA P10253 2/20 0.41
USP2 O75604 1/20 0.38
HTT P42858 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 2/20 0.38
POLB P06746 1/20 0.38
RBP4 P02753 1/20 0.37
TSHR P16473 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL3377374 0.91 HRH3 (0.42) HPGDSMN1; SMN2HRH3ALDH1A1KDM4E
SCHEMBL3377289 0.85 SMN1; SMN2 (0.44) HPGDSMN1; SMN2HRH3ALDH1A1KDM4E
SCHEMBL3379879 0.84 HRH3 (0.41) SMN1; SMN2HRH3ALDH1A1KDM4EHTT
SCHEMBL3377941 0.83 HRH3 (0.40) SMN1; SMN2HRH3ALDH1A1KDM4EGAA
SCHEMBL3376466 0.83 ALDH1A1 (0.44) SMN1; SMN2HRH3ALDH1A1KMT2AMEN1
SCHEMBL3377886 0.83 KMT2A (0.41) SMN1; SMN2HRH3ALDH1A1KDM4EKMT2A
SCHEMBL3378180 0.82 HRH3 (0.51) HPGDSMN1; SMN2HRH3ALDH1A1KDM4E
SCHEMBL3374944 0.81 PKM (0.40) HRH3ALDH1A1KDM4EHTTKMT2A
SCHEMBL3376421 0.80 HRH3 (0.44) HRH3ALDH1A1KMT2AMEN1POLB
SCHEMBL3377237 0.79 HRH3 (0.41) HRH3ALDH1A1KDM4EKMT2AMEN1

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-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP disclosed