SCHEMBL482018

SCHEMBL482018

COCCOc1cc(C#N)c([N+](=O)[O-])cc1OCCOC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.43
GRIA1 P42261 2/20 0.43
GRIA2 P42262 2/20 0.43
GRIA3 P42263 2/20 0.43
GRIA4 P48058 2/20 0.43
GRM6 O15303 1/20 0.43
CYP1A2 P05177 1/20 0.43
ALOX15 P16050 1/20 0.43
HPGD P15428 2/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
APEX1 P27695 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
VCAM1 P19320 1/20 0.42
RECQL P46063 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 3/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL15365139 0.96 MAPT (0.45) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15365263 0.96 ALDH1A1 (0.45) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15366047 0.96 ALDH1A1 (0.45) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL5651215 0.96 MAPT (0.45) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15365148 0.96 ALDH1A1 (0.45) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL20866201 0.90 LMNA (0.39) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15365609 0.90 ALDH1A1 (0.41) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15365285 0.89 MAPT (0.40) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15365067 0.89 MAPT (0.40) MAPTGRIA1GRIA2GRIA3GRIA4
SCHEMBL15372369 0.87 LMNA (0.40) MAPTGRIA1GRIA2GRIA3GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108999-B Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2023-11-03 CN claimed
CN-115108999-A Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2022-09-27 CN claimed
CN-112300082-A Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2021-02-02 CN claimed
WO-2007138612-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4- YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 WO claimed
WO-2007138613-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4-YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 WO claimed
CN-122059883-A Production and preparation method of erlotinib intermediate 安徽尖峰北卡药业有限公司 2026-05-19 CN disclosed
CN-115108999-B Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2023-11-03 CN disclosed
CN-114920704-B Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2023-11-03 CN disclosed
CN-115108999-A Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2022-09-27 CN disclosed
CN-114920704-A Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2022-08-19 CN disclosed
US-20220235014-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE ERLOTINIB HYDROCHLORIDE SHIVALIK RASAYAN LIMITED (IN) 2022-07-28 US disclosed
CN-112300082-B Phenyl piperazine quinazoline compound or pharmaceutically acceptable salt thereof, preparation method and application 暨南大学 2022-04-26 CN disclosed
WO-2010109443-A1 PROCESS FOR THE PREPARATION OF ERLOTINIB OR ITS PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF RANBAXY LABORATORIES LIMITED (IN) 2010-09-30 WO disclosed
US-20100094004-A1 Process for Preparation of Erlotinib and its Pharmaceutically Acceptable Salts CIPLA LIMITED (IN) 2010-04-15 US disclosed
EP-2139868-A2 PROCESS FOR PREPARATION OF ERLOTINIB AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS Cipla Limited (IN) 2010-01-06 EP disclosed
WO-2008122776-A2 PROCESS FOR PREPARATION OF ERLOTINIB AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS CIPLA LIMITED (IN) 2008-10-16 WO disclosed
WO-2007138612-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4- YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 WO disclosed
WO-2007138612-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4- YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 WO disclosed
WO-2007138613-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4-YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 WO disclosed
WO-2007138613-A2 A PROCESS FOR SYNTHESIS OF [6,7-BIS-(2-METHOXYETHOXY)-QUINAZOLIN-4-YL]-(3-ETHYNYLPHENYL)AMINE HYDROCHLORIDE VITTAL MALLYA SCIENTIFIC RESEARCH FOUNDATION (IN) 2007-12-06 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-20100094004-A1 Process for Preparation of Erlotinib and its Pharmaceutically Acceptable Salts ABL1, EGFR, KRAS MAPT 2403/4885GRIA1 2824/4885GRIA2 2299/4885
US-20220235014-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE ERLOTINIB HYDROCHLORIDE EGFR, KRAS, ERBB4 MAPT 4008/4885GRIA1 3809/4885GRIA2 4402/4885

“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.