SCHEMBL3073296

SCHEMBL3073296

Sc1ncc2ccccc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
GPR3 P46089 1/20 0.46
EGFR P00533 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
ACHE P22303 1/20 0.44
CYP1A2 P05177 6/20 0.43
HTR3A P46098 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
NPC1 O15118 2/20 0.41
NCF1 P14598 1/20 0.38
NOS2 P35228 1/20 0.38
BACE1 P56817 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
NQO2 P16083 1/20 0.37
CYP2A6 P11509 1/20 0.37
PDPK1 O15530 1/20 0.37

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
SCHEMBL27687560 0.96 KDM4E (0.43) KDM4EGPR3EGFRALDH1A1MAPT
Benzylphenylether SCHEMBL8814955 0.80 CYSLTR2 (0.50) MAPTCYP1A2NPC1
SCHEMBL1672650 0.75 CYP1A2 (0.60) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL30198446 0.75 CYP1A2 (0.60) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL30527184 0.75 CYP1A2 (0.60) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL11024480 0.73 ALDH1A1 (0.48) KDM4EGPR3ALDH1A1MAPTCYP1A2
SCHEMBL329760 0.71 KDM4E (0.46) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL13911016 0.71 CYP1A2 (0.56) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL163312 0.71 KDM4E (0.46) KDM4EGPR3EGFRALDH1A1MAPT
SCHEMBL7900625 0.71 KDM4E (0.52) KDM4EGPR3EGFRALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108456214-A The quinazoline compounds and its application of Han oxazoles or glyoxaline structure 江西科技师范大学 2018-08-28 CN claimed
JP-1006261-A None JP disclosed
US-20230357261-A1 ARYL HYDROCARBON RECEPTOR LIGANDS AND THEIR ANALOGUES FOR THE PREVENTION AND TREATMENT OF INFLAMMATORY DISORDERS The University of Pittsburgh- of the Commonwealth System of Higher Education 2023-11-09 US disclosed
EP-3822258-B1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THIN FILM FORMED FROM THE COMPOSITION SAMSUNG DISPLAY CO LTD (KR) 2022-06-15 EP disclosed
EP-3502107-B1 1-AMINODIBENZOFURAN-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2022-01-26 EP disclosed
US-20200240995-A1 KDAC VARIANTS AND USES THEREOF MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2020-07-30 US disclosed
EP-3684923-A1 KDAC VARIANTS AND USES THEREOF Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-07-29 EP disclosed
WO-2019057925-A1 KDAC VARIANTS AND USES THEREOF MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2019-03-28 WO disclosed
CN-108456214-A The quinazoline compounds and its application of Han oxazoles or glyoxaline structure 江西科技师范大学 2018-08-28 CN disclosed
EP-3339395-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2018-06-27 EP disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-5296579-A From (hydro)sulfide, polyhalogenated aromatic compound and a mercaptan PHILLIPS PETROLEUM COMPANY (US) 1994-03-22 US disclosed
JP-S646261-A 4-THIOQUINAZOLINE DERIVATIVE, ITS PRODUCTION AND ANTIULCER AGENT CONTAINING SAID DERIVATIVE AS ACTIVE COMPONENT NISSHIN FLOUR MILLING CO 1989-01-10 JP disclosed
US-4294581-A ANTHRAQUINONE DYES BASF AKTIENGESELLSCHAFT (DE) 1981-10-13 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-20230357261-A1 ARYL HYDROCARBON RECEPTOR LIGANDS AND THEIR ANALOGUES FOR THE PREVENTION AND TREATMENT OF INFLAMMATORY DISORDERS AHR, ARNT, MTNR1A KDM4E 4317/4885GPR3 125/4885EGFR 1221/4885

“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.