SCHEMBL7956181

SCHEMBL7956181

COc1cc(CN2CCC(Cc3ccc(F)cc3)(C(CC(C)(C)C)O[SiH](C)C)C2=O)cc(OC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HTT P42858 2/20 0.38
KDM4E B2RXH2 1/20 0.38
KCNH2 Q12809 2/20 0.37
HRH1 P35367 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
PRMT5 O14744 1/20 0.34
LMNA P02545 2/20 0.34
SSTR5 P35346 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL6993970 0.92 KCNH2 (0.38) ALDH1A1HTTKDM4EKCNH2HRH1
SCHEMBL7956395 0.91 MEN1 (0.38) ALDH1A1ACHE
SCHEMBL7961302 0.91 KDM4E (0.37) ALDH1A1HTTKDM4ESMN1; SMN2LMNA
SCHEMBL7961444 0.90 MEN1 (0.35) ALDH1A1HTTKDM4EKCNH2HRH1
SCHEMBL7956188 0.81 ALDH1A1 (0.38) ALDH1A1HTTKDM4EKCNH2HRH1
SCHEMBL7958676 0.79 KMT2A (0.41) KCNH2
SCHEMBL6993981 0.79 KCNH2 (0.37) ALDH1A1HTTKDM4EKCNH2HRH1
SCHEMBL7947321 0.78 MEN1 (0.37) ALDH1A1ACHE
SCHEMBL7947394 0.74 KMT2A (0.48) ALDH1A1KDM4EKCNH2
SCHEMBL7961451 0.73 MEN1 (0.37) ALDH1A1HTTKDM4EKCNH2HRH1

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 3 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
WO-1996006094-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1996-02-29 WO disclosed