SCHEMBL18499080

SCHEMBL18499080

CCCCCCCCCc1cc2ccccc2[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.57
ALDH1A1 P00352 8/20 0.55
HSD17B10 Q99714 5/20 0.55
HPGD P15428 4/20 0.55
GAA P10253 3/20 0.52
CYP1A2 P05177 1/20 0.51
TSHR P16473 2/20 0.50
MAPT P10636 2/20 0.50
BRD4 O60885 1/20 0.50
CTSV O60911 1/20 0.50
CTSL P07711 1/20 0.50
OPRK1 P41145 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
ALOX15 P16050 1/20 0.49
PDE10A Q9Y233 1/20 0.47
IL4I1 Q96RQ9 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL11709052 1.00 KDM4E (0.57) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL30274765 1.00 KDM4E (0.57) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL1370758 0.98 KDM4E (0.59) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL13349416 0.87 KDM4E (0.59) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL9254420 0.83 KDM4E (0.51) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL1263927 0.82 KDM4E (0.66) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL31154599 0.82 KDM4E (0.66) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL7646960 0.81 DAO (0.53) KDM4EALDH1A1HSD17B10HPGDCYP1A2
Bromide SCHEMBL31326904 0.81 KDM4E (0.49) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL24853036 0.80 IL4I1 (0.55) KDM4EALDH1A1HSD17B10HPGDGAA

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-9566284-B2 Agents and methods for treating ischemic and other diseases NONO INC. (CA) 2017-02-14 US disclosed
US-9566284-B2 Agents and methods for treating ischemic and other diseases NONO INC. (CA) 2017-02-14 US disclosed