SCHEMBL10695426

SCHEMBL10695426

NC(=O)OC1CCCN(CCOc2ccc(Cl)cc2Cl)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.56
GAA P10253 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 3/20 0.48
KCNA5 P22460 1/20 0.47
HPGD P15428 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
HTT P42858 2/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 2/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CACNA1F O60840 1/20 0.43

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
SCHEMBL10696993 0.76 KDM4E (0.54) KDM4EGAATDP1LMNAALDH1A1
SCHEMBL10695808 0.75 KDM4E (0.48) KDM4EGAATDP1SMN1; SMN2LMNA
SCHEMBL19048091 0.74 CYP1A2 (0.61) KDM4ESMN1; SMN2LMNAALDH1A1KCNA5
SCHEMBL10695529 0.74 HRH3 (0.55) KDM4ELMNAALDH1A1KCNA5
SCHEMBL10697150 0.72 KDM4E (0.56) KDM4EGAALMNAALDH1A1MEN1
SCHEMBL10697040 0.72 KDM4E (0.67) KDM4EGAATDP1SMN1; SMN2LMNA
SCHEMBL3600901 0.71 KDM1A (0.61) KDM4EKCNA5MEN1KMT2ANPC1
SCHEMBL3837994 0.71 LTA4H (0.55) KDM4ESMN1; SMN2ALDH1A1KCNA5MEN1
Oxalic Acid SCHEMBL10695599 0.71 KDM4E (0.59) KDM4EGAALMNAALDH1A1MEN1
SCHEMBL29042805 0.71 CHRNB2 (0.41) KDM4ESMN1; SMN2ALDH1A1MAOB

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