SCHEMBL30337692

SCHEMBL30337692

Nc1ccc(-c2ccc(-c3ccc(N)cn3)cc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
TP53 P04637 3/20 0.44
NPC1 O15118 3/20 0.44
MAPT P10636 3/20 0.44
HPGD P15428 3/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM1A O60341 6/20 0.43
CYP3A4 P08684 2/20 0.43
MAOB P27338 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41

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
SCHEMBL8974216 1.00 METAP2 (0.45) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL6804411 0.97 METAP2 (0.48) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL30087143 0.97 METAP2 (0.48) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL9237008 0.89 KDM1A (0.57) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL13192068 0.89 KDM1A (0.57) ALDH1A1MEN1KMT2ANPC1MAPT
SCHEMBL18573201 0.89 NPC1 (0.49) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL30436719 0.89 NPC1 (0.53) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL3173634 0.89 NPC1 (0.53) METAP2CYP11B1CYP11B2ALDH1A1MEN1
SCHEMBL15614080 0.89 HSD17B10 (0.56) CYP11B1CYP11B2ALDH1A1MEN1KMT2A
SCHEMBL6508767 0.89 KDM1A (0.57) METAP2CYP11B1CYP11B2ALDH1A1TP53

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
CN-115974067-A High-thermal-conductivity graphite film of pyridine ring modified polyimide and preparation method thereof 富优特(山东)新材料科技有限公司 2023-04-18 CN claimed
CN-115974067-A High-thermal-conductivity graphite film of pyridine ring modified polyimide and preparation method thereof 富优特(山东)新材料科技有限公司 2023-04-18 CN disclosed