SCHEMBL1845197

SCHEMBL1845197

Nc1cc(Cl)c2ccccc2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 2/20 0.60
▸ NCF1 P14598 10/20 0.53
▸ MAOA P21397 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ GLA P06280 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ CASP1 P29466 2/20 0.50
▸ CASP7 P55210 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ ACHE P22303 2/20 0.50
▸ CHRM2 P08172 1/20 0.50
▸ ADRA2A P08913 1/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ NQO2 P16083 1/20 0.50
▸ DRD1 P21728 1/20 0.50
▸ SLC6A2 P23975 1/20 0.50
▸ ADRA1A P35348 1/20 0.50

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
SCHEMBL29690490 0.78 NCF1 (0.64) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL29420516 0.78 MAOA (0.54) MAOAKDM4EALDH1A1GLAHPGD
SCHEMBL397020 0.78 MAOA (0.54) MAOAKDM4EALDH1A1GLAHPGD
SCHEMBL323374 0.78 NCF1 (0.64) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL5640307 0.78 NR4A2 (0.53) BACE1ACHECHRM1LMNATP53
SCHEMBL832716 0.76 BACE1 (0.56) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL482375 0.75 BACE1 (0.60) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL31667822 0.75 BACE1 (0.60) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL3094768 0.75 BACE1 (1.00) BACE1NCF1MAOAKDM4EALDH1A1
SCHEMBL2950892 0.75 BACE1 (0.60) BACE1NCF1MAOAKDM4EALDH1A1

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
EP-4010330-B1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS HIRUNDO BIOSCIENCES (BE) 2025-10-01 — — EP disclosed
US-20230373974-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
US-20230373974-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
US-20230373974-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
EP-4225750-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR Vertex Pharmaceuticals Incorporated (US) 2023-08-16 — — EP disclosed
EP-3618829-B1 QUINAZOLINE-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER-RELATED DISORDERS ARCUS BIOSCIENCES INC (US) 2023-06-07 — — EP disclosed
EP-3618829-B1 QUINAZOLINE-PYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER-RELATED DISORDERS ARCUS BIOSCIENCES INC (US) 2023-06-07 — — EP disclosed
CN-110612100-B Quinazoline-pyridine derivatives for the treatment of diseases associated with cancer 艾库斯生物科学有限公司 2023-04-14 — — CN disclosed
US-20220388979-A1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2022-12-08 — — US disclosed
US-20220388979-A1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2022-12-08 — — US disclosed
US-6339093-B1 Isoquinoline derivatives HOFFMANN-LA ROCHE INC. 2002-01-15 — — US disclosed
EP-1090917-A1 Quinolin-4-yl derivatives and their use as NMDA-receptor subtype blockers F. HOFFMANN-LA ROCHE AG (CH) 2001-04-11 — — EP disclosed
CN-1290698-A Quinoline-4-base deviative I HOFFMANN LA ROCHE (CH) 2001-04-11 — — CN disclosed
EP-1088818-A1 Quinolin-4-yl derivatives F. HOFFMANN-LA ROCHE AG (CH) 2001-04-04 — — EP disclosed
US-4279912-A ANTIALLERGENS, BRONCHODILATORS ROUSSEL UCLAF (FR) 1981-07-21 — — US disclosed
US-4075343-A Anti-allergenic 5-alkoxyimidazo[1,2-A]quinoline-2-carboxylic acids and derivatives thereof PFIZER INC. (US) 1978-02-21 — — US disclosed
US-4066766-A 1-Oxo-6-substituted pyrimido [1,2-a]quinoline-2-carboxylic acids and derivatives thereof and their use as antiallergy agents PFIZER INC. (US) 1978-01-03 — — US disclosed
US-4031217-A PYRIMIDINE-QUINOLINE COMPOUNDS PFIZER INC. (US) 1977-06-21 — — US disclosed
US-4017625-A Anti-allergic N-(5-tetrazolyl)-1-oxo-1H-6-alkoxypyrimido-[1,2-a]quinoline-2-carboxamides and intermediates therefor PFIZER INC. (US) 1977-04-12 — — US disclosed
US-4014881-A ANTIULCER AGENTS PFIZER INC. (US) 1977-03-29 — — 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 (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-20220388979-A1 QUINOLINE DERIVATIVES AS PROTEIN KINASE INHIBITORS ABL1, PHKB, EEF2K BACE1 3682/4885NCF1 1153/4885MAOA 3238/4885
US-20230373974-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B BACE1 4670/4885NCF1 990/4885MAOA 4476/4885

“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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