SCHEMBL9353032

SCHEMBL9353032

O=C(O)COCCN1CCC(OCc2ccccc2-c2ccc(F)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 2/20 0.54
PRMT6 Q96LA8 2/20 0.54
BCHE P06276 5/20 0.51
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
HTR7 P34969 3/20 0.42
HTR1A P08908 2/20 0.42
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
CHRM3 P20309 2/20 0.41
TDP1 Q9NUW8 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
SCHEMBL9352689 0.90 CARM1 (0.57) CARM1PRMT6BCHEKDM4EALDH1A1
SCHEMBL9352867 0.90 CARM1 (0.54) CARM1PRMT6BCHEKDM4EALDH1A1
SCHEMBL9356829 0.89 CARM1 (0.54) CARM1PRMT6BCHEKDM4EALDH1A1
SCHEMBL9353388 0.88 CARM1 (0.55) CARM1PRMT6BCHEKDM4EALDH1A1
SCHEMBL9353218 0.85 CARM1 (0.55) CARM1PRMT6BCHESMN1; SMN2FFAR1
Hydrochloric Acid SCHEMBL9353413 0.84 CARM1 (0.54) CARM1PRMT6BCHESMN1; SMN2FFAR1
SCHEMBL2058741 0.83 HRH3 (0.49) KDM4EALDH1A1HTR7HTR1AMEN1
Water SCHEMBL10930920 0.82 HRH3 (0.48) KDM4EALDH1A1HTR7HTR1AMEN1
SCHEMBL9352932 0.81 CARM1 (0.51) CARM1PRMT6BCHEALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL9357218 0.77 CARM1 (0.57) CARM1PRMT6SMN1; SMN2MEN1KMT2A

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-0399414-B1 Piperidine derivative, method for preparation thereof, and a pharmaceutical composition comprising the same HOKURIKU PHARMACEUTICAL (JP) 1994-09-21 EP disclosed