SCHEMBL9302654

SCHEMBL9302654

CNC(C1CCN(C(=O)c2ccccc2F)CC1)C1COc2ccccc2O1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK14 Q16539 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD11B1 P28845 1/20 0.43
GAA P10253 2/20 0.42
MAPK1 P28482 2/20 0.41
MGLL Q99685 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TSHR P16473 2/20 0.41
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL9301405 0.85 ACHE (0.46) EPHX2KDM4EKMT2ACYP2C19ALDH1A1
SCHEMBL9301293 0.83 LMNA (0.46) EPHX2MEN1KMT2AALDH1A1HSD11B1
SCHEMBL9302303 0.80 EPHX2 (0.47) EPHX2KDM4EMEN1KMT2AALDH1A1
SCHEMBL9301807 0.80 TSHR (0.45) KDM4EMEN1KMT2AALDH1A1HSD11B1
SCHEMBL9301986 0.80 CYP2D6 (0.46) MEN1KMT2ACYP2C19ALDH1A1HSD11B1
SCHEMBL9301620 0.79 RBP4 (0.48) MEN1KMT2AALDH1A1HSD11B1MGLL
SCHEMBL9302321 0.78 ATM (0.42) KDM4EKMT2AALDH1A1MAPK1MAPT
SCHEMBL9302670 0.73 ADRA1D (0.60) CYP2C9CYP2C19MAPK14ALDH1A1MAPK1
SCHEMBL13503788 0.73 KDM4E (0.61) EPHX2KDM4EMEN1KMT2ACYP2C9
SCHEMBL9302549 0.72 LMNA (0.43) KDM4EMEN1KMT2ACYP2C9CYP2C19

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
US-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US claimed
US-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US disclosed