SCHEMBL29429002

SCHEMBL29429002

Nc1cc2cc(N)c(N)cc2cc1N

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.64
TDP1 Q9NUW8 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CHEK1 O14757 1/20 0.41
POLB P06746 2/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
CACNA1B Q00975 1/20 0.40
APBA1 Q02410 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.38
CYP3A4 P08684 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
ALOX15 P16050 4/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL1599775 1.00 PTK2 (0.64) PTK2TDP1MEN1KMT2ACHEK1
SCHEMBL29516961 0.95 PTK2 (0.58) PTK2TDP1MEN1KMT2ACHEK1
SCHEMBL5605593 0.95 PTK2 (0.58) PTK2TDP1MEN1KMT2ACHEK1
SCHEMBL10692546 0.82 PTK2 (0.44) PTK2TDP1MEN1KMT2ACHEK1
SCHEMBL10691404 0.82 GAA (0.50) PTK2TDP1CHEK1NPC1GAA
SCHEMBL10690888 0.82 CYP3A4 (0.53) PTK2TDP1MAPTGAACYP3A4
SCHEMBL10688867 0.82 PTK2 (0.44) PTK2TDP1MEN1KMT2ACHEK1
SCHEMBL15939956 0.79 ALDH1A1 (0.62) PTK2TDP1MEN1KMT2APOLB
SCHEMBL18623484 0.79 CYP3A4 (0.58) PTK2TDP1POLBMAPTGAA
SCHEMBL633786 0.79 ALDH1A1 (0.62) PTK2TDP1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119912701-A Phthalocyanine-based metal-organic framework catalyst and synthesis method and application thereof 安阳工学院 2025-05-02 CN claimed
CN-114122394-B Polyoxazine material and preparation method and application thereof 超威电源集团有限公司 2024-01-26 CN claimed
CN-114122394-A Polyoxazine material and preparation method and application thereof 浙江裕源储能科技有限公司 2022-03-01 CN claimed
CN-121824873-A Polymer-based tetraatom cluster electrocatalyst material, and preparation method and application thereof 武汉纺织大学 2026-04-10 CN disclosed
CN-119912701-A Phthalocyanine-based metal-organic framework catalyst and synthesis method and application thereof 安阳工学院 2025-05-02 CN disclosed
CN-119569977-A Preparation method and application of metal diatomic polymer catalyst 武汉纺织大学 2025-03-07 CN disclosed
CN-112543781-B Polybenzimidazole oligomers having reactive end groups PBI性能产品公司 2024-02-20 CN disclosed
CN-114122394-B Polyoxazine material and preparation method and application thereof 超威电源集团有限公司 2024-01-26 CN disclosed
CN-114122394-B Polyoxazine material and preparation method and application thereof 超威电源集团有限公司 2024-01-26 CN disclosed
CN-116948148-A Preparation of branched epoxy resin pressure-bearing plugging material and oil-based drilling fluid 西南石油大学 2023-10-27 CN disclosed
CN-113166409-B Polyimide precursor, polyimide resin film, and flexible device 东丽株式会社 2023-07-28 CN disclosed
CN-111133054-B Polyimide precursor resin composition, polyimide resin composition, and polyimide resin film 东丽株式会社 2022-11-11 CN disclosed
CN-114122394-A Polyoxazine material and preparation method and application thereof 浙江裕源储能科技有限公司 2022-03-01 CN disclosed
CN-114122394-A Polyoxazine material and preparation method and application thereof 浙江裕源储能科技有限公司 2022-03-01 CN disclosed