SCHEMBL521524

SCHEMBL521524

Nc1ccc2c(c1)NC(=O)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 1/20 1.00
▸ MAPT P10636 3/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ NPC1 O15118 1/20 0.55
▸ MAPK13 O15264 1/20 0.55
▸ MAPK12 P53778 1/20 0.55
▸ MAPK11 Q15759 1/20 0.55
▸ MAPK14 Q16539 1/20 0.55
▸ MAOB P27338 10/20 0.48
▸ MAOA P21397 8/20 0.48
▸ CRBN Q96SW2 1/20 0.48
▸ SMYD3 Q9H7B4 1/20 0.46
▸ AOC3 Q16853 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44

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
SCHEMBL29370621 1.00 CA9 (1.00) CA9MAPTKDM4EKMT2AMEN1
SCHEMBL995002 0.89 CA9 (0.80) CA9MAPTKDM4EKMT2AMEN1
Methane SCHEMBL28569951 0.87 CA9 (0.77) CA9MAPTKDM4EKMT2AMEN1
SCHEMBL736368 0.85 CA9 (0.73) CA9MAPTKDM4EKMT2AMEN1
Hydrochloric Acid SCHEMBL17544899 0.83 CA9 (0.71) CA9MAPTKDM4EKMT2AMEN1
SCHEMBL30468520 0.82 CA9 (0.70) CA9MAPTKDM4EKMT2AMEN1
SCHEMBL398137 0.82 CA9 (0.70) CA9MAPTKDM4EKMT2AMEN1
Hydrochloric Acid SCHEMBL9833199 0.81 CA9 (0.68) CA9MAPTKDM4EKMT2AMEN1
Methylamine SCHEMBL28015139 0.79 CA9 (0.66) CA9MAPTKDM4EKMT2AMEN1
SCHEMBL15424346 0.78 CA9 (0.64) CA9MAPTKDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230478-A1 4-Alkyl-substituted diaminopyrimidines Bayer ScienceCrop AG (DE) 2011-09-22 — — US claimed
EP-2330904-A2 4-ALKYL-SUBSTITUTED DIAMINOPYRIMIDINES Bayer CropScience AG (DE) 2011-06-15 — — EP claimed
US-20110105472-A1 Diaminopyrimidines as crop protection agents BAYER CROPSCIENCE AG (DE) 2011-05-05 — — US claimed
WO-2010025863-A2 4-ALKYL-SUBSTITUTED DIAMINOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2010-03-11 — — WO claimed
WO-2010025871-A1 4-HALOGEN ALKYL-SUBSTITUTED DIAMINOPYRIMIDINES FOR USE AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 — — WO claimed
EP-2161259-A1 4-Haloalkyl substituted Diaminopyrimidine Bayer CropScience AG (DE) 2010-03-10 — — EP claimed
US-20260098028-A1 Compounds and Their Use for Treatment of Hemoglobinopathies BRISTOL-MYERS SQUIBB COMPANY (US) 2026-04-09 — — US disclosed
US-12441711-B2 Compounds and their use for treatment of hemoglobinopathies BRISTOL-MYERS SQUIBB COMPANY (US) 2025-10-14 — — US disclosed
EP-4612128-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF HEMOGLOBINOPATHIES Bristol-Myers Squibb Company (US) 2025-09-10 — — EP disclosed
US-20250163025-A1 Compounds and Their Use for Treatment of Hemoglobinopathies BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-22 — — US disclosed
WO-2025067168-A1 AZA FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2025-04-03 — — WO disclosed
US-20250084055-A1 DIHYDROQUINOLINONES FOR MEDICAL TREATMENT C4 THERAPEUTICS, INC. (US) 2025-03-13 — — US disclosed
US-20240343707-A1 SUBSTITUTED PHENYL ETHYNYL PYRIMIDINES AS POTENT INHIBITORS OF ALPHAVIRUSES SOUTHERN RESEARCH INSTITUTE 2024-10-17 — — US disclosed
EP-0322746-B1 Heterocyclic compounds ORION YHTYMAE OY (FI) 1996-05-29 — — EP disclosed
EP-0675172-A2 Water-solable azo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-04 — — EP disclosed
US-5373019-A Pharmaceutical lactam compositions for inhibition of erythrocyte and thrombocyte aggregation BOEHRINGER MANNHEIM GMBH (DE) 1994-12-13 — — US disclosed
US-4985448-A Ureidoindoles, pharmaceutical compositions and methods for erythrocyte and thrombocyte aggregation inhibition BOEHRINGER MANNHEIM GMBH (DE) 1991-01-15 — — US disclosed
US-4963677-A TREATMENT OF CONGESTIVE HEART FAILURE ORION CORPORATION LTD. (FI) 1990-10-16 — — US disclosed
EP-0322746-A1 Heterocyclic compounds ORION CORPORATION LIMITED (FI) 1989-07-05 — — EP disclosed
US-4415572-A CARDIOTONIC AND INOTROPIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1983-11-15 — — US 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 (7 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-20240343707-A1 SUBSTITUTED PHENYL ETHYNYL PYRIMIDINES AS POTENT INHIBITORS OF ALPHAVIRUSES PRNP, PNP, ZC3HAV1 CA9 4072/4885MAPT 496/4885KDM4E 444/4885
US-20110230478-A1 4-Alkyl-substituted diaminopyrimidines DPM1, DPYD, POLR1C CA9 2561/4885MAPT 4144/4885KDM4E 1081/4885
US-20250084055-A1 DIHYDROQUINOLINONES FOR MEDICAL TREATMENT CRBN, RBX1, ADRM1 CA9 4311/4885MAPT 2439/4885KDM4E 1168/4885
US-20250163025-A1 Compounds and Their Use for Treatment of Hemoglobinopathies HBG1, HBG2, HBB CA9 3208/4885MAPT 4138/4885KDM4E 2011/4885
US-20110105472-A1 Diaminopyrimidines as crop protection agents DDX41, DDX1, DDX5 CA9 1421/4885MAPT 4235/4885KDM4E 2179/4885
US-12441711-B2 Compounds and their use for treatment of hemoglobinopathies HBG1, HBG2, HBB CA9 3208/4885MAPT 4138/4885KDM4E 2011/4885
US-20260098028-A1 Compounds and Their Use for Treatment of Hemoglobinopathies HBZ, HBG2, HBB CA9 309/4885MAPT 3444/4885KDM4E 2471/4885

“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.

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