SCHEMBL7423977

SCHEMBL7423977

N#Cc1cc(NCc2cccnc2)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
PABPC1 P11940 1/20 0.56
LTA4H P09960 1/20 0.52
ALDH1A1 P00352 4/20 0.52
CYP3A4 P08684 4/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
KDM4E B2RXH2 2/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
USP2 O75604 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PGK1 P00558 1/20 0.48

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
SCHEMBL10558180 0.77 CYP3A4 (0.68) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL5714168 0.77 ALDH1A1 (0.64) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL10814853 0.76 KDM4C (0.60) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL7577205 0.76 CYP3A4 (0.57) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL6730573 0.75 LTA4H (0.72) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL6732492 0.75 LTA4H (0.66) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL10814098 0.74 ALDH1A1 (0.59) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL10812477 0.74 LTA4H (0.56) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL10813207 0.73 LTA4H (0.52) MAPTMEN1KMT2APABPC1LTA4H
SCHEMBL19190687 0.73 RAB9A (0.52) MAPTMEN1KMT2APABPC1LTA4H

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