SCHEMBL10690668

SCHEMBL10690668

OCC1CCCN(CCCCOc2cccc(C(F)(F)F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.53
LTA4H P09960 1/20 0.51
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
CNR2 P34972 1/20 0.49
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
HTR1A P08908 1/20 0.45
HTR7 P34969 1/20 0.45
EPHX2 P34913 1/20 0.45

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
Oxalic Acid SCHEMBL10692238 0.96 KDM4E (0.55) HRH3KMT2AMEN1KDM4EALDH1A1
SCHEMBL9532091 0.85 HRH3 (0.50) HRH3LTA4HKMT2AMEN1KDM4E
SCHEMBL9698943 0.82 DRD2 (0.51) HRH3LTA4H
Hydrochloric Acid SCHEMBL9528697 0.81 DRD2 (0.50) HRH3LTA4H
SCHEMBL10692724 0.81 HRH3 (0.49) HRH3LTA4HKMT2AMEN1KDM4E
SCHEMBL10692369 0.78 KMT2A (0.53) HRH3LTA4HKMT2AMEN1KDM4E
SCHEMBL10690170 0.78 KMT2A (0.50) HRH3LTA4HKMT2AMEN1KDM4E
SCHEMBL8695235 0.75 LTA4H (0.57) HRH3LTA4HKDM4EALDH1A1LMNA
SCHEMBL7401247 0.75 HRH3 (0.58) HRH3LTA4HKMT2AMEN1KDM4E
SCHEMBL10697150 0.74 KDM4E (0.56) HRH3LTA4HKMT2AMEN1KDM4E

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
EP-0252876-A1 Hydrogenated 1-phenoxyalkylpyridine-3-carboxylic-acid compounds CIBA-GEIGY AG (CH) 1988-01-13 EP claimed
EP-0252876-A1 Hydrogenated 1-phenoxyalkylpyridine-3-carboxylic-acid compounds CIBA-GEIGY AG (CH) 1988-01-13 EP disclosed