SCHEMBL7465460

SCHEMBL7465460

CC(C)(C)OC(=O)N1CCC(C(=O)c2nc3ccccc3n2Cc2ccco2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 3/20 0.51
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 1/20 0.47
TACR2 P21452 1/20 0.44
TACR1 P25103 1/20 0.44
HTT P42858 1/20 0.44
NOD2 Q9HC29 1/20 0.43
NOD1 Q9Y239 1/20 0.43
STS P08842 1/20 0.43
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL7473715 0.88 HRH1 (0.55) HRH1MAPTALDH1A1MEN1GAA
SCHEMBL7471630 0.87 HRH1 (0.44) HRH1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL7899281 0.86 HRH1 (0.54) HRH1GAASMN1; SMN2TACR2TACR1
SCHEMBL9697550 0.85 HRH1 (0.43) HRH1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL7468735 0.83 HRH1 (0.41) HRH1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL7475435 0.83 HRH1 (0.51) HRH1TACR2TACR1NOD2NOD1
SCHEMBL7958395 0.83 HRH1 (0.64) HRH1ALDH1A1GAATACR2TACR1
SCHEMBL13317058 0.81 KDM4E (0.54) HRH1MEN1GAAKMT2AKDM4E
SCHEMBL7479016 0.80 NOD2 (0.45) HRH1MAPTGAAKDM4ESMN1; SMN2
SCHEMBL7479020 0.80 NOD2 (0.43) HRH1MAPTGAAKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882038-B1 SUBSTITUTED N-METHYL-N-(4-(PIPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2002-12-18 EP disclosed
US-6329392-B1 ANTIALLERGENS AVENTIS PHARMACEUTICALS, INC. 2001-12-11 US disclosed
US-6297259-B1 HISTAMINE RECEPTOR ANTAGONISTS AND TACHYKININ RECEPTOR ANTAGONISTS. AVENTIS PHARMACEUTICALS INC. 2001-10-02 US disclosed
US-5998439-A RESPIRATORY SYSTEM DISORDERS Hoescht Marion Roussel, Inc. (US) 1999-12-07 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