SCHEMBL7961447

SCHEMBL7961447

COc1cc(CN2CCC(CCO[Si](C)(C)C(C)(C)C)(Cc3ccc(F)cc3F)C2=O)cc(OC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.38
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
ACHE P22303 1/20 0.33
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KCNH2 Q12809 1/20 0.32
PRMT5 O14744 1/20 0.32
MAPK1 P28482 1/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7002664 0.90 HRH1 (0.40) HRH1KDM4EALDH1A1HTTLMNA
SCHEMBL7971732 0.88 HRH1 (0.38) HRH1MEN1KMT2AKDM4EALDH1A1
SCHEMBL6993974 0.85 HRH1 (0.40) HRH1KDM4EALDH1A1HTTLMNA
SCHEMBL6997660 0.85 MAPK1 (0.39) HRH1MEN1KMT2AALDH1A1ACHE
SCHEMBL7961305 0.85 KDM4E (0.39) HRH1MEN1KMT2AKDM4EHTT
SCHEMBL7961053 0.85 MEN1 (0.42) HRH1MEN1KMT2ANPC1KDM4E
SCHEMBL7000714 0.84 SMN1; SMN2 (0.41) HRH1MEN1KMT2AALDH1A1HTT
SCHEMBL6992818 0.84 ABCB1 (0.36) HRH1MEN1KMT2AHTTLMNA
SCHEMBL7003238 0.83 TSHR (0.33) HRH1MEN1KMT2AKDM4EALDH1A1
SCHEMBL7954527 0.82 KDM4E (0.41) HRH1MEN1KMT2ANPC1KDM4E

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