SCHEMBL28149189

SCHEMBL28149189

O=CN1CCCC1c1ccc(F)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 1/20 0.45
TSHR P16473 1/20 0.45
LMNA P02545 1/20 0.45
PTBP1 P26599 1/20 0.45
MAPT P10636 2/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
GFER P55789 1/20 0.42
ATM Q13315 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
GAA P10253 2/20 0.40
NR3C2 P08235 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
SCHEMBL27852341 0.95 TRPA1 (0.48) TRPA1SMN1; SMN2MAPK1TSHRLMNA
SCHEMBL8540223 0.93 TRPA1 (0.47) TRPA1SMN1; SMN2MAPK1TSHRLMNA
SCHEMBL8540221 0.93 TRPA1 (0.47) TRPA1SMN1; SMN2MAPK1TSHRLMNA
SCHEMBL2296429 0.83 TSHR (0.45) MAPK1TSHRLMNAALDH1A1ATM
SCHEMBL28217526 0.83 SLC18A3 (0.36) TRPA1ALDH1A1
SCHEMBL13330544 0.82 CHRNB2 (0.55) LMNAMAPTALDH1A1
SCHEMBL28148132 0.82 PDE2A (0.40) TRPA1TSHR
SCHEMBL28167653 0.81 RIPK1 (0.54) TSHRLMNAMAPT
SCHEMBL30824575 0.81 RIPK1 (0.54) TSHRLMNAMAPT
SCHEMBL4158117 0.79 ALDH1A1 (0.42) TRPA1MAPK1LMNAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968371-A Novel PRMT5 inhibitor and application thereof 上海湃隆生物科技有限公司 2025-05-09 CN disclosed
CN-106817900-A Novel naphthyridines and isoquinolin and its purposes as CDK8/19 inhibitor 默克专利有限公司 2017-06-09 CN disclosed