SCHEMBL8421925

SCHEMBL8421925

COCCCc1ccc(C#CC2C(O)C3CCN2CC3)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.34
FFAR4 Q5NUL3 2/20 0.33
HRH3 Q9Y5N1 2/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
KCNH2 Q12809 1/20 0.32
ACACB O00763 1/20 0.31
LMNA P02545 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MEN1 O00255 1/20 0.30
CYP2D6 P10635 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM1A O60341 1/20 0.30
GAA P10253 1/20 0.30
KDM4E B2RXH2 1/20 0.30
L3MBTL3 Q96JM7 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8918241 0.86 SPHK1 (0.45) CHRM5CHRM1CHRM3LMNASPHK1
SCHEMBL8417998 0.79 FDFT1 (0.40) ALDH1A1KDM4E
SCHEMBL8421884 0.76 KDM4E (0.34) KCNH2KDM4E
SCHEMBL8921096 0.74 ALDH1A1 (0.35) HRH3ALDH1A1L3MBTL3L3MBTL1CHRNA7
SCHEMBL8420023 0.73 TSHR (0.35) KMT2AL3MBTL1
SCHEMBL8707234 0.71 HRH3 (0.37) HRH3ACACBKDM4E
SCHEMBL8920052 0.71 KMT2A (0.53) LMNAALDH1A1MEN1RAB9AKMT2A
SCHEMBL8420280 0.68 HRH3 (0.33) FFAR4HRH3CYP2D6
SCHEMBL8420501 0.67 MEN1 (0.39) HRH3KCNH2ALDH1A1MEN1CYP2D6
SCHEMBL8969941 0.67 FDFT1 (0.61)

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
US-5919793-A QUINUCLIDINE DERIVATIVES, SQUALENE SYNTHETASE INHIBITORS, ANTICHOLESTEROL AGENTS ZENECA LIMITED (GB) 1999-07-06 US disclosed