SCHEMBL18264334

SCHEMBL18264334

O=C1COc2cc(Br)c(Cl)cc2N1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.49
PKM P14618 2/20 0.46
MAPT P10636 7/20 0.45
TP53 P04637 4/20 0.45
PARP1 P09874 1/20 0.45
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
THRB P10828 1/20 0.44
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL30015636 1.00 MMP12 (0.49) MMP12PKMMAPTTP53PARP1
SCHEMBL24286262 0.93 MMP12 (0.49) MMP12PKMMAPTTP53PARP1
SCHEMBL2945700 0.86 MMP12 (0.54) MMP12PKMMAPTTP53PARP1
SCHEMBL2955843 0.86 MMP12 (0.54) MMP12PKMMAPTTP53PARP1
SCHEMBL5914785 0.80 NR3C2 (0.51) MMP12PKMMAPTTP53PARP1
SCHEMBL3342717 0.80 MMP12 (0.49) MMP12PKMMAPTTP53PARP1
SCHEMBL12067736 0.80 ACLY (0.49) MMP12PKMMAPTTP53PARP1
SCHEMBL3592276 0.80 MMP12 (0.49) MMP12PKMMAPTTP53PARP1
SCHEMBL1853066 0.80 MMP12 (0.57) MMP12PKMMAPTTP53PARP1
SCHEMBL30557601 0.80 ACLY (0.49) MMP12PKMMAPTTP53PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084815-A Synthesis method of 7-bromo-6-chloro-3, 4-dihydro-2H-1, 4-benzoxazine 南通大学 2024-05-28 CN claimed
CN-118084815-A Synthesis method of 7-bromo-6-chloro-3, 4-dihydro-2H-1, 4-benzoxazine 南通大学 2024-05-28 CN disclosed
US-11932633-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2024-03-19 US disclosed
CN-110092782-B Benzo-hexaazacyclo compound and preparation method and application thereof 中国科学院广州生物医药与健康研究院 2022-10-21 CN disclosed
US-20210380570-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2021-12-09 US disclosed
CN-107646034-B 3- (6-chloro-3-oxo-3, 4-dihydro- (2H) -1, 4-benzoxazin-4-yl) propionic acid derivatives or their use as KMO inhibitors 爱丁堡大学理事会 2021-06-15 CN disclosed
EP-3790551-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2021-03-17 EP disclosed
US-10611756-B2 Method of treating pancreatitis using 1,4-benzoxazine derivatives THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) 2020-04-07 US disclosed
US-10611756-B2 Method of treating pancreatitis using 1,4-benzoxazine derivatives THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) 2020-04-07 US disclosed
WO-2019217307-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2019-11-14 WO disclosed
US-20190169178-A1 METHODS DR. FALK PHARMA GMBH (DE) 2019-06-06 US disclosed
US-20190169178-A1 METHODS DR. FALK PHARMA GMBH (DE) 2019-06-06 US disclosed
US-10246447-B2 3-(6-chloro-3-oxo-3,4-dihydro-(2H)-1,4-benzoxazin-4-yl) propanoic acid derivatives and their use as KMO inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-04-02 US disclosed
US-10246447-B2 3-(6-chloro-3-oxo-3,4-dihydro-(2H)-1,4-benzoxazin-4-yl) propanoic acid derivatives and their use as KMO inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-04-02 US disclosed
US-20180170920-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS DR. FALK PHARMA GMBH (DE) 2018-06-21 US disclosed
US-20180170920-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS DR. FALK PHARMA GMBH (DE) 2018-06-21 US disclosed
US-20180170920-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS DR. FALK PHARMA GMBH (DE) 2018-06-21 US disclosed
EP-3298009-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-03-28 EP disclosed
WO-2016188827-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-12-01 WO disclosed
WO-2016188827-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2016-12-01 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 (6 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-10611756-B2 Method of treating pancreatitis using 1,4-benzoxazine derivatives AMY2A, KMO, KLK5 MMP12 497/4885PKM 235/4885MAPT 4609/4885
US-10246447-B2 3-(6-chloro-3-oxo-3,4-dihydro-(2H)-1,4-benzoxazin-4-yl) propanoic acid derivatives and their use as KMO inhibitors KMO, SNCA, AP1S1 MMP12 1430/4885PKM 515/4885MAPT 496/4885
US-20180170920-A1 3-(6-CHLORO-3-OXO-3,4-DIHYDRO-(2H)-1,4-BENZOXAZIN-4-YL) PROPANOIC ACID DERIVATIVES AND THEIR USE AS KMO INHIBITORS KMO, SNCA, AP1S1 MMP12 1430/4885PKM 515/4885MAPT 496/4885
US-20210380570-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MMP12 1433/4885PKM 4596/4885MAPT 3928/4885
US-20190169178-A1 METHODS KMO, AMY2A, RNASE1 MMP12 726/4885PKM 160/4885MAPT 3972/4885
US-11932633-B2 KRas G12C inhibitors KRAS, NRAS, HRAS MMP12 1433/4885PKM 4596/4885MAPT 3928/4885

“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.