SCHEMBL21336726

SCHEMBL21336726

CC1CN(c2ccccc2)CC(C)N1C(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.56
RORC P51449 1/20 0.43
ABCB1 P08183 1/20 0.43
NR1H2 P55055 5/20 0.42
NR1H3 Q13133 4/20 0.42
FAAH O00519 2/20 0.40
NAMPT P43490 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 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
SCHEMBL18436754 0.87 GPR119 (0.56) GPR119ALDH1A1LMNAMAPT
SCHEMBL24681357 0.86 GPR119 (0.43) GPR119RORCNR1H2NR1H3ALDH1A1
SCHEMBL19001024 0.86 HSD11B1 (0.51) GPR119RORCALDH1A1LMNAMAPT
SCHEMBL6073574 0.86 GPR119 (0.43) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL5726247 0.86 GPR119 (0.43) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL5782035 0.85 GPR119 (0.46) GPR119NR1H2NR1H3
SCHEMBL7661674 0.85 GPR119 (0.58) GPR119ALDH1A1LMNAMAPT
SCHEMBL7661671 0.85 GPR119 (0.58) GPR119ALDH1A1LMNAMAPT
SCHEMBL21142472 0.84 GPR119 (0.54) GPR119RORCABCB1NR1H2NR1H3
SCHEMBL19838611 0.84 GPR119 (0.54) GPR119RORCABCB1NR1H2NR1H3

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
EP-3124482-B1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-09-11 EP disclosed