SCHEMBL2909003

SCHEMBL2909003

[c]1nc(-c2ccccc2)cc(-c2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.52
KMT2A Q03164 8/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
ADORA2A P29274 2/20 0.52
ADORA1 P30542 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
RAB9A P51151 3/20 0.48
MAPT P10636 5/20 0.46
TDP1 Q9NUW8 2/20 0.46
AGTR1 P30556 1/20 0.46
TSHR P16473 1/20 0.46
ATM Q13315 1/20 0.46
NTSR1 P30989 1/20 0.45
POLB P06746 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43

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
SCHEMBL2909035 0.84 L3MBTL1 (0.44) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL27929127 0.83 KDM4E (0.54) ALDH1A1HPGDL3MBTL1SMN1; SMN2RAB9A
SCHEMBL557899 0.75 KMT2A (0.41) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL9920492 0.74 MEN1 (0.68) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL27942235 0.74 GABRA1 (0.41) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL733365 0.74 GABRA1 (0.45) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL284286 0.72 ASIC3 (0.71) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL12806833 0.72 GABRA1 (0.54) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL438540 0.72 MEN1 (0.75) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL13133548 0.72 MEN1 (0.65) MEN1KMT2AALDH1A1HPGDL3MBTL1

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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111138418-B Organic heterocyclic compound, application thereof and organic electroluminescent device 北京绿人科技有限责任公司 2022-11-08 CN claimed
CN-118159623-A Boron-and nitrogen-containing heterocyclic compounds for organic electroluminescent devices 默克专利有限公司 2024-06-07 CN disclosed
CN-117980439-A Boron-containing heterocyclic compounds for organic electroluminescent devices 默克专利有限公司 2024-05-03 CN disclosed
CN-117430618-A Organic compound, application thereof and organic electroluminescent device 北京绿人科技有限责任公司 2024-01-23 CN disclosed
CN-117425655-A Nitrogen-containing heterocyclic compound for organic electroluminescent device 默克专利有限公司 2024-01-19 CN disclosed
WO-2023041454-A1 BORONIC HETEROCYCLIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-03-23 WO disclosed
CN-111138418-B Organic heterocyclic compound, application thereof and organic electroluminescent device 北京绿人科技有限责任公司 2022-11-08 CN disclosed
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 CN disclosed
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 WO disclosed
WO-2019163959-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCNET ELEMENT, AND ELECTRON-TRANSPORTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2019-08-29 WO disclosed
EP-1252158-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES Pfizer Products Inc. (US) 2002-10-30 EP disclosed
US-20020123520-A1 Thiazolyl-, oxazolyl-, pyrrolyl-, and imidazolyl-acid amide derivatives useful as inhibitors of PDE4 isozymes PFIZER INC. 2002-09-05 US disclosed
US-20020111495-A1 Nicotinamide acids, amides, and their mimetics active as inhibitors of PDE4 isozymes PFIZER INC. 2002-08-15 US disclosed
WO-2002060875-A1 NICOTINAMIDE BIARYL DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2002-08-08 WO disclosed
WO-2002060898-A1 THIAZOLYL-, OXAZOLYL-, PYRROLYL-, AND IMIDAZOLYL-ACID AMIDE DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2002-08-08 WO disclosed
WO-2002060896-A1 ETHER DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2002-08-08 WO disclosed
EP-1229034-A1 Nicotinamide derivatives and their mimetics as inhibitors of PDE4 isozymes Pfizer Products Inc. (US) 2002-08-07 EP disclosed
WO-2002051814-A1 BENZOYLPYRIDAZINES MERCK PATENT GMBH (DE) 2002-07-04 WO disclosed
WO-2001057025-A1 PYRIMIDINE CARBOXAMIDES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2001-08-09 WO disclosed
WO-2001057036-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2001-08-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020123520-A1 Thiazolyl-, oxazolyl-, pyrrolyl-, and imidazolyl-acid amide derivatives useful as inhibitors of PDE4 isozymes CBR1, CBR3, PDE4A MEN1 4836/4885KMT2A 3274/4885ALDH1A1 434/4885
US-20020111495-A1 Nicotinamide acids, amides, and their mimetics active as inhibitors of PDE4 isozymes NOX3, NOX1, NOX4 MEN1 4317/4885KMT2A 3442/4885ALDH1A1 457/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.