SCHEMBL2320060

SCHEMBL2320060

O=CNc1ccc(-c2ccc(Cl)cc2)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.45
EGLN1 Q9GZT9 2/20 0.42
RAB9A P51151 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LTA4H P09960 1/20 0.40
MAP4K4 O95819 1/20 0.40
PTK2 Q05397 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EGFR P00533 1/20 0.38
IGF1R P08069 1/20 0.38
MET P08581 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38

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
SCHEMBL183711 0.85 L3MBTL1 (0.55) RAB9ASMN1; SMN2NPC1MEN1KMT2A
SCHEMBL212774 0.84 ACHE (0.45) DEGS1RAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL2320835 0.82 FLT1 (0.44) EGLN1RAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2360453 0.82 WNT3A (0.42) EGLN1RAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2360146 0.82 TEK (0.49) KDRTEK
SCHEMBL2321384 0.81 DEGS1 (0.41) DEGS1EGLN1RAB9ASMN1; SMN2NPC1
SCHEMBL2325030 0.78 DEGS1 (0.48) DEGS1EGLN1RAB9ANPC1ALDH1A1
SCHEMBL2359971 0.78 KIF11 (0.43) DEGS1RAB9ANPC1KDRTEK
SCHEMBL2324964 0.78 EPHB4 (0.48) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL11472883 0.76 LTA4H (0.47) DEGS1EGLN1RAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011094890-A1 PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS ARGUSINA INC. (US) 2011-08-11 WO disclosed