SCHEMBL6187801

SCHEMBL6187801

Cc1cc([N+](=O)[O-])ccc1OCc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HTT P42858 2/20 0.51
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
MEN1 O00255 3/20 0.47
MAPT P10636 3/20 0.47
SYK P43405 5/20 0.46
AURKB Q96GD4 2/20 0.46
INCENP Q9NQS7 2/20 0.46
EGFR P00533 1/20 0.46
ERBB2 P04626 1/20 0.46
POLB P06746 1/20 0.45
MGMT P16455 1/20 0.45
PKM P14618 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP2D6 P10635 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
SCHEMBL6187792 0.90 ALDH1A1 (0.54) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL30354912 0.87 ALDH1A1 (0.59) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL6017266 0.87 ALDH1A1 (0.59) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL29151328 0.85 ALDH1A1 (0.47) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL29151259 0.85 LMNA (0.43) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL30354787 0.85 LMNA (0.43) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL30218362 0.84 MAPT (0.58) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL29780767 0.84 MAPT (0.58) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL6068967 0.84 S1PR4 (0.50) KMT2AALDH1A1HTTAPOBEC3AAPOBEC3G
SCHEMBL6068707 0.84 S1PR4 (0.44) KMT2AALDH1A1MEN1MAPTSYK

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897214-B2 Quinazoline derivatives ZENECA LIMITED (GB) 2005-05-24 US disclosed
EP-0880507-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2005-04-13 EP disclosed
US-20030018029-A1 Quinazoline derivatives ZENECA LIMITED 2003-01-23 US disclosed
US-6399602-B1 ANTICANCER AGENTS ZENECA LIMITED (GB) 2002-06-04 US disclosed
US-5955464-A USE OF THE RECEPTOR TYROSINE KINASE INHIBITORY PROPERTIES OF THE COMPOUNDS IN THE TREATMENT OF PROLIFERATIVE DISEASE SUCH AS CANCER ZENECA LIMITED (GB) 1999-09-21 US disclosed
EP-0794953-B1 QUINAZOLINE DERIVATIVES ZENECA LTD (GB) 1999-05-06 EP disclosed
US-5866572-A RECEPTOR TYROSINE KINASE INHIBITORY PROPERTIES, TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER. ZENECA LIMITED (GB) 1999-02-02 US disclosed
EP-0790986-B1 ANILINE DERIVATIVES ZENECA LTD (GB) 1999-01-20 EP disclosed
EP-0880507-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
US-5821246-A USEFUL AS TYROSINE KINASE INHIBITORS AND FOR THE TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER ZENECA LIMITED (GB) 1998-10-13 US disclosed
EP-0794953-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-17 EP disclosed
EP-0790986-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1997-08-27 EP disclosed
WO-1997030034-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1997-08-21 WO disclosed
WO-1996016960-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1996-06-06 WO disclosed
WO-1996015118-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1996-05-23 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 (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-20030018029-A1 Quinazoline derivatives ABL1, FGFR1, ERBB2 KMT2A 953/4885ALDH1A1 1329/4885HTT 2841/4885

“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.