SCHEMBL22804146

SCHEMBL22804146

Cc1ccc2ccc(-c3cnccn3)nc2n1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
METAP2 P50579 1/20 0.37
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
PIM1 P11309 1/20 0.36
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL30433854 0.77 MIF (0.43) MEN1KMT2AMETAP2HTTALDH1A1
SCHEMBL22824613 0.77 MIF (0.43) MEN1KMT2AMETAP2HTTALDH1A1
SCHEMBL30528336 0.77 CCR1 (0.61) MEN1KMT2AMETAP2HTTRECQL
SCHEMBL13750594 0.74 CYP1A2 (0.40) METAP2HTTRECQLALDH1A1CYP1A2
SCHEMBL7509409 0.72 CCR1 (0.58) KMT2AMETAP2CYP1A2
SCHEMBL22127684 0.70 METAP2 (0.33) METAP2
SCHEMBL5788862 0.70 HTT (0.42) METAP2HTTRECQLALDH1A1CYP1A2
SCHEMBL78566 0.69 NISCH (0.50) METAP2HTTRECQLALDH1A1CYP1A2
SCHEMBL29598957 0.69 NISCH (0.50) METAP2HTTRECQLALDH1A1CYP1A2
SCHEMBL29454745 0.69 NISCH (0.50) METAP2HTTRECQLALDH1A1CYP1A2

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
CN-110272417-B 2-methyl-1, 8-naphthyridine compound and preparation method and application thereof 五邑大学 2021-07-13 CN disclosed
WO-2020253415-A1 2-METHYL-1,8-NAPHTHYRIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREFOR 五邑大学 2020-12-24 WO disclosed
WO-2020253415-A1 2-METHYL-1,8-NAPHTHYRIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREFOR 五邑大学 2020-12-24 WO disclosed