SCHEMBL7423012

SCHEMBL7423012

Oc1ccc(Oc2ccccc2NCc2cccnc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.48
LTA4H P09960 1/20 0.48
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
NAMPT P43490 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 1/20 0.45
CACNA1B Q00975 1/20 0.45
KDM4C Q9H3R0 1/20 0.44
ADRA2C P18825 1/20 0.44
CYP19A1 P11511 1/20 0.44
MMP13 P45452 1/20 0.44
NOTUM Q6P988 1/20 0.44

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
SCHEMBL11213631 0.88 LTA4H (0.60) MAPK14LTA4HLMNAMAPTALDH1A1
SCHEMBL7423017 0.81 LTA4H (0.60) LTA4HLMNAMAPTALDH1A1KDM4E
SCHEMBL17873926 0.76 LTA4H (0.60) LTA4HLMNAMAPTALDH1A1KDM4E
SCHEMBL6727553 0.74 LTA4H (0.58) LTA4HLMNAMAPTALDH1A1KDM4E
SCHEMBL6730999 0.74 LTA4H (0.58) LTA4HLMNAMAPTALDH1A1KDM4E
SCHEMBL6730573 0.74 LTA4H (0.72) LTA4HMAPTALDH1A1KDM4EMEN1
SCHEMBL11215406 0.74 CACNA1B (0.63) KDM4ECACNA1BADRA2C
SCHEMBL10993717 0.73 LTA4H (0.60) LTA4HMAPTALDH1A1KDM4EMEN1
SCHEMBL11216885 0.73 CACNA1B (0.54) MAPK14CACNA1BADRA2C
SCHEMBL10561472 0.73 ALDH1A1 (0.52) LTA4HLMNAMAPTALDH1A1KDM4E

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-1255735-A2 PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2002-11-13 EP disclosed
WO-2001056990-A2 PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2001-08-09 WO disclosed