SCHEMBL5318974

SCHEMBL5318974

Oc1ccccc1Oc1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
CYP19A1 P11511 4/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PPARD Q03181 1/20 0.43
GRM5 P41594 1/20 0.43
HTT P42858 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
LTA4H P09960 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
SCHEMBL17870243 0.85 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL2873531 0.79 CA1 (0.45) LMNAALDH1A1MAPK1HSD17B10HTT
SCHEMBL5318389 0.78 ALDH1A1 (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL5332097 0.78 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL11483460 0.78 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL11477740 0.78 TDP1 (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL9922005 0.78 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL11573009 0.78 ALDH1A1 (0.59) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL11478665 0.78 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL29449754 0.78 TTR (0.57) LMNAALDH1A1HSD17B10CA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO claimed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed
WO-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed