SCHEMBL10696841

SCHEMBL10696841

Cc1ccc(OCCN2CCCC(CO)C2)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.54
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
LTA4H P09960 2/20 0.50
MAPT P10636 1/20 0.49
ACHE P22303 1/20 0.47
PSMB1 P20618 1/20 0.46
PSMB5 P28074 1/20 0.46
PSMB2 P49721 1/20 0.46
KDM1A O60341 1/20 0.46
KCNA5 P22460 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
SCHEMBL8695235 0.86 LTA4H (0.57) HRH3KDM4EALDH1A1LMNALTA4H
SCHEMBL8973715 0.82 KDM4E (0.78) HRH3KDM4EALDH1A1LMNA
SCHEMBL21780941 0.78 HRH3 (0.56) HRH3KDM4ELTA4HKDM1A
SCHEMBL15834053 0.78 HRH3 (0.66) HRH3KDM4ELTA4HPSMB1PSMB5
SCHEMBL8337754 0.78 HRH3 (0.70) HRH3KDM4EALDH1A1LTA4HPSMB1
SCHEMBL10700027 0.78 HRH3 (0.53) HRH3KDM4EALDH1A1LMNALTA4H
SCHEMBL10191924 0.78 LTA4H (0.67) HRH3ALDH1A1LTA4H
SCHEMBL13980797 0.78 LTA4H (0.67) HRH3ALDH1A1LTA4H
SCHEMBL11171280 0.77 CYP2D6 (0.50) HRH3KDM4EALDH1A1LMNALTA4H
SCHEMBL10696993 0.77 KDM4E (0.54) HRH3KDM4EALDH1A1LMNALTA4H

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