SCHEMBL8117474

SCHEMBL8117474

Brc1[c]ccc(Oc2cccnc2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
CYP19A1 P11511 3/20 0.48
HTT P42858 1/20 0.44
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
LTA4H P09960 2/20 0.40
GRM5 P41594 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
TGFBR1 P36897 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37

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
SCHEMBL8126363 0.81 LMNA (0.61) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL920902 0.81 LMNA (0.61) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL8124450 0.81 LMNA (0.61) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL8124884 0.81 LMNA (0.61) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL8121297 0.79 LMNA (0.59) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL25268910 0.79 LTA4H (0.48) HTTALDH1A1SMN1; SMN2LTA4H
SCHEMBL676142 0.76 LMNA (0.82) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL30535283 0.76 LMNA (0.82) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL8124461 0.76 LMNA (0.50) LMNATDP1CYP19A1HTTALDH1A1
SCHEMBL694392 0.75 LMNA (0.62) LMNATDP1CYP19A1HTTALDH1A1

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-1028945-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS Amgen Inc. (US) 2000-08-23 EP disclosed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO disclosed