SCHEMBL7947451

SCHEMBL7947451

OC1(c2nc3ccccc3n2Cc2ccc(F)cc2)CCN(CCC2(Cc3ccccc3)CCN(Cc3ccccc3)C2)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
HTR3A P46098 1/20 0.42
HRH1 P35367 11/20 0.41
CYP2D6 P10635 8/20 0.41
CHRM1 P11229 5/20 0.41
KCNH2 Q12809 5/20 0.41
POLB P06746 1/20 0.41
NR4A2 P43354 1/20 0.41
RAB9A P51151 1/20 0.39

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
SCHEMBL7958381 0.97 KMT2A (0.45) SSTR5KMT2AMEN1HTR3AHRH1
SCHEMBL7956819 0.90 HRH1 (0.49) HRH1
SCHEMBL7947466 0.89 HRH1 (0.48) SSTR5HRH1
SCHEMBL7956245 0.85 HRH1 (0.50) HRH1
SCHEMBL7955924 0.83 HRH1 (0.51) HRH1
SCHEMBL7956187 0.82 HRH1 (0.49) SSTR5KMT2AMEN1HRH1KCNH2
SCHEMBL1387253 0.82 SSTR5 (0.42) SSTR5HTR3AHRH1CYP2D6CHRM1
SCHEMBL7947445 0.81 SSTR5 (0.41) SSTR5KMT2AMEN1HTR3AHRH1
SCHEMBL8307210 0.80 SSTR5 (0.41) SSTR5HTR3AHRH1CYP2D6CHRM1
SCHEMBL8303798 0.78 SSTR5 (0.41) SSTR5HTR3AHRH1CYP2D6CHRM1

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-6329392-B1 ANTIALLERGENS AVENTIS PHARMACEUTICALS, INC. 2001-12-11 US disclosed
EP-0777666-B1 SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMA INC (US) 1999-03-03 EP disclosed
EP-0777666-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1997-06-11 EP disclosed
WO-1996006094-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1996-02-29 WO disclosed