SCHEMBL2712784

SCHEMBL2712784

c1cnc(-c2ccncc2)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
LMNA P02545 1/20 0.56
CYP2A6 P11509 1/20 0.54
NOTUM Q6P988 1/20 0.52
CYP19A1 P11511 2/20 0.52
CLK4 Q9HAZ1 1/20 0.50
ADRB2 P07550 1/20 0.50
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGDS O60760 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 2/20 0.42
PKM P14618 2/20 0.42
ALDH1A1 P00352 1/20 0.42
BACE1 P56817 1/20 0.42
DDAH1 O94760 1/20 0.41

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
SCHEMBL19219066 0.95 MAPT (0.58) MAPTLMNACYP2A6NOTUMCYP19A1
SCHEMBL6685962 0.84 CLK4 (0.64) MAPTLMNACYP2A6CLK4ADRB2
SCHEMBL9974945 0.84 MAPT (0.46) MAPTLMNACYP2A6NOTUMCYP19A1
SCHEMBL16625771 0.81 CLK4 (0.61) MAPTLMNACYP2A6CLK4ADRB2
Pyridine SCHEMBL28854029 0.81 CYP2A6 (0.60) LMNACYP2A6NOTUMCLK4ADRB2
SCHEMBL5572579 0.80 MAPT (0.53) MAPTLMNANOTUMCYP19A1KDM4E
SCHEMBL16614448 0.79 MAPT (0.47) MAPTLMNACYP2A6NOTUMCYP19A1
SCHEMBL33833 0.79 NPC1 (0.62) CYP2A6NOTUMCLK4ADRB2L3MBTL1
SCHEMBL28062294 0.79 NPC1 (0.62) CYP2A6NOTUMCLK4ADRB2L3MBTL1
SCHEMBL21012627 0.78 NOTUM (0.48) MAPTLMNACYP2A6NOTUMCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114907388-A Synthesis of three-dimensional microporous cadmium compound and application of three-dimensional microporous cadmium compound in pesticide residue pymetrozine detection 皖西学院 2022-08-16 CN claimed
CN-107434801-B 4 '-pyridyl-pyrimidine class compounds of one kind and its synthetic method and application 南京林业大学 2019-08-27 CN claimed
CN-107434801-A A kind of 4 ' pyridyl-pyrimidine class compounds and its synthetic method and application 南京林业大学 2017-12-05 CN claimed
EP-1314732-A2 Substituted pyrimidine compounds and their use AMGEN INC. (US) 2003-05-28 EP claimed
EP-0948497-A2 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE Amgen inc. (US) 1999-10-13 EP claimed
WO-1998024782-A2 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO claimed
US-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof DONG-A ST CO., LTD. (KR) 2025-03-04 US disclosed
CN-117561239-A Pyridinium derivatives prepared by hydrothermal synthesis for use as anode electrolytes in electrochemical cells 威斯康星州男校友研究基金会 2024-02-13 CN disclosed
US-20240026218-A1 METAL-ASSISTED DELAYED FLUORESCENT MATERIALS AS CO-HOST MATERIALS FOR FLUORESCENT OLEDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2024-01-25 US disclosed
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-25 US disclosed
US-20240026218-A1 METAL-ASSISTED DELAYED FLUORESCENT MATERIALS AS CO-HOST MATERIALS FOR FLUORESCENT OLEDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2024-01-25 US disclosed
US-11795387-B2 Metal-assisted delayed fluorescent materials as co-host materials for fluorescent OLEDs ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-10-24 US disclosed
US-11795387-B2 Metal-assisted delayed fluorescent materials as co-host materials for fluorescent OLEDs ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-10-24 US disclosed
CN-1246856-A Aryl and heteroaryl substituted fused pyrrole antiinflammatory agents AMGEN INC (US) 2000-03-08 CN disclosed
CN-1236363-A Process for production of 4-substituted-3-halogeno-1, 4-benzoxazepine derivative and salts thereof SUNTORY LTD (JP) 1999-11-24 CN disclosed
WO-1999043699-A1 STREPTOGRAMIN DERIVATIVES, PREPARATION METHOD AND COMPOSITIONS CONTAINING SAME AVENTIS PHARMA S.A. (FR) 1999-09-02 WO disclosed
EP-0925288-A1 PROCESS OF PRODUCTION OF 4-SUBSTITUTED-3-HALOGENO-1,4-BENZOXAZEPINE DERIVATIVE AND SALTS THEREOF SUNTORY LIMITED (JP) 1999-06-30 EP disclosed
WO-1999003847-A1 PROCESS OF PRODUCTION OF 4-SUBSTITUTED-3-HALOGENO-1,4-BENZOXAZEPINE DERIVATIVE AND SALTS THEREOF SUNTORY LIMITED (JP) 1999-01-28 WO disclosed
EP-0755930-A1 BENZOXAZEPINE DERIVATIVES, SALTS THEREOF, AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-01-29 EP disclosed
US-4927827-A Pyridinylpyrimidine derivatives, method for production thereof and a fungicide containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-22 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 (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-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof EIF2AK4, GCN1, GCGR MAPT 2789/4885LMNA 1854/4885CYP2A6 1926/4885
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF EIF2AK4, GCN1, GCGR MAPT 2789/4885LMNA 1854/4885CYP2A6 1926/4885

“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.