SCHEMBL272708

SCHEMBL272708

N#Cc1c([N+](=O)[O-])ccc(Cl)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.60
VCAM1 P19320 8/20 0.54
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.43
MERTK Q12866 2/20 0.40
ALDH1A1 P00352 2/20 0.39
EGFR P00533 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36

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
Hydroxyamine SCHEMBL6264479 0.95 TDP1 (0.55) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL8313813 0.87 VCAM1 (0.56) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL30583791 0.85 TDP1 (0.60) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL894816 0.85 TDP1 (0.60) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL28571587 0.82 VCAM1 (0.51) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL6581238 0.82 VCAM1 (0.51) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL7550938 0.82 VCAM1 (0.47) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL21961905 0.80 TDP1 (0.49) TDP1VCAM1TSHRMAPK1MERTK
SCHEMBL2001345 0.79 VCAM1 (0.51) TDP1VCAM1TSHRMAPK1RAB9A
SCHEMBL8390568 0.79 VCAM1 (0.51) TDP1VCAM1TSHRMAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006999-B1 A PROCESS FOR THE PRODUCTION OF 2-CHLOROBENZONITRILE DERIVATIVES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1981-04-01 EP claimed
US-4225534-A FROM CHLORINATED 2-NITROBENZONITRILES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-09-30 US claimed
EP-0006999-A1 A process for the production of 2-chlorobenzonitrile derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-01-23 EP claimed
US-20260078135-A1 POLYCYCLIC QUINAZOLINES FOR INHIBITION OF ERBB2 ENLIVEN INC (US) 2026-03-19 US disclosed
EP-4587124-A1 POLYCYCLIC QUINAZOLINES FOR INHIBITION OF ERBB2 Enliven Inc. (US) 2025-07-23 EP disclosed
WO-2024059558-A1 POLYCYCLIC QUINAZOLINES FOR INHIBITION OF ERBB2 ENLIVEN INC. (US) 2024-03-21 WO disclosed
CN-102757434-B Preparation method for industrial amplified production of anagrelide hydrochloride active pharmaceutical ingredient HEILONGJIANG TIMEHOME PHARMACEUTICAL CO LTD 2014-06-04 CN disclosed
CN-102757434-A Preparation method for industrial amplified production of anagrelide hydrochloride active pharmaceutical ingredient HEILONGJIANG TIMEHOME PHARMACEUTICAL CO LTD 2012-10-31 CN disclosed
US-8133996-B2 Process for the preparation of ethyl-N-(2,3-dichloro-6-nitrobenzyl)glycine hydrochloride CIPLA LIMITED (IN) 2012-03-13 US disclosed
US-8133996-B2 Process for the preparation of ethyl-N-(2,3-dichloro-6-nitrobenzyl)glycine hydrochloride CIPLA LIMITED (IN) 2012-03-13 US disclosed
US-8133996-B2 Process for the preparation of ethyl-N-(2,3-dichloro-6-nitrobenzyl)glycine hydrochloride CIPLA LIMITED (IN) 2012-03-13 US disclosed
US-5391737-A Process for the preparation of 6,7-dichloro-1,5-dihydroimidazo[2,1-b]quinazolin-2[3H]-one EGIS GYOGYSZERGYAR (HU) 1995-02-21 US disclosed
EP-0514917-A1 Process for and 2-(cyanoimino)-quinazoline derivatives useful as intermediates in the preparation of 6,7-di-(chloro)-1,5-di(hydro)-imidazo-[2,1-b]quinazolin-2[3H]-one and process for preparing the 2-(cyanoimino)-quinazoline derivatives EGIS GYOGYSZERGYAR (HU) 1992-11-25 EP disclosed
EP-0133234-B1 IMIDAZOQUINAZOLIN-2-ONE COMPOUNDS PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS DAIICHI SEIYAKU CO., LTD. (JP) 1989-04-12 EP disclosed
US-4610987-A ANTICOAGULANT DAIICHI SEIYAKU CO., LTD. (JP) 1986-09-09 US disclosed
EP-0133234-A2 Imidazoquinazolin-2-one compounds process for their production and pharmaceutical compositions containing said compounds DAIICHI SEIYAKU CO., LTD. (JP) 1985-02-20 EP disclosed
EP-0006999-B1 A PROCESS FOR THE PRODUCTION OF 2-CHLOROBENZONITRILE DERIVATIVES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1981-04-01 EP disclosed
US-4225534-A FROM CHLORINATED 2-NITROBENZONITRILES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-09-30 US disclosed
EP-0006999-A1 A process for the production of 2-chlorobenzonitrile derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-01-23 EP disclosed
US-4146718-A BLOOD PLATELET ANTIAGGREGATIVE AGENT BRISTOL-MYERS COMPANY (US) 1979-03-27 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 (1 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-20260078135-A1 POLYCYCLIC QUINAZOLINES FOR INHIBITION OF ERBB2 ERBB2, BRCA1, ERBB3 TDP1 2757/4885VCAM1 3940/4885TSHR 211/4885

“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.