SCHEMBL1458588

SCHEMBL1458588

CCCCCc1nc(N)c2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 14/20 0.57
▸ TLR7 Q9NYK1 6/20 0.53
▸ ATM Q13315 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ DCPS Q96C86 1/20 0.49

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
SCHEMBL28203089 0.98 TLR8 (0.58) TLR8TLR7ATMSMN1; SMN2LMNA
SCHEMBL22498767 0.98 TLR8 (0.58) TLR8TLR7ATMSMN1; SMN2LMNA
SCHEMBL29377718 0.98 TLR8 (0.58) TLR8TLR7ATMSMN1; SMN2LMNA
SCHEMBL28504818 0.90 TLR8 (0.51) TLR8TLR7ATMSMN1; SMN2LMNA
SCHEMBL28229720 0.88 KDM4E (0.55) TLR8TLR7DCPS
SCHEMBL28510573 0.88 TLR8 (0.54) TLR8TLR7LMNATSHR
SCHEMBL28508187 0.87 TLR8 (0.48) TLR8TLR7LMNATSHR
SCHEMBL28503550 0.85 TLR8 (0.54) TLR8TLR7LMNA
SCHEMBL28906706 0.82 TLR8 (0.54) TLR8TLR7LMNA
SCHEMBL13585880 0.82 TLR8 (0.48) TLR8TLR7ATMSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112457260-B N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2023-01-17 — — CN claimed
CN-112457260-A N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2021-03-09 — — CN claimed
CN-112457260-B N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2023-01-17 — — CN disclosed
CN-112457260-B N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2023-01-17 — — CN disclosed
CN-112457260-B N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2023-01-17 — — CN disclosed
CN-114835683-A Quinazoline-4, 6-diamine compound containing morpholinyl aromatic heterocycle and preparation method thereof 江苏食品药品职业技术学院 2022-08-02 — — CN disclosed
CN-112457260-A N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2021-03-09 — — CN disclosed
CN-112457260-A N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2021-03-09 — — CN disclosed
CN-112457260-A N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof 江苏食品药品职业技术学院 2021-03-09 — — CN disclosed
US-8796180-B2 Aminoquinazoline compounds for combating invertebrate pests BASF SE (DE) 2014-08-05 — — US disclosed
EP-2480537-A1 AMINOQUINAZOLINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2012-08-01 — — EP disclosed
EP-1654236-A1 NAPHTHYLENE DERIVATIVES AS CYTOCHROME P450 INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-05-10 — — EP disclosed
CN-1242993-C Heterocycle derivatives and drugs NIPPON SHINYAKU CO LTD (JP) 2006-02-22 — — CN disclosed
US-20060009645-A1 Naphthylene derivatives as cytochrome P450 inhibitors OSI PHARMACEUTICALS, INC. 2006-01-12 — — US disclosed
CN-1597671-A Quinazoline deriative and preparation method and bioactivity UNIV GUIZHOU (CN) 2005-03-23 — — CN disclosed
WO-2005007631-A1 NAPHTHYLENE DERIVATIVES AS CYTOCHROME P450 INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-01-27 — — WO disclosed
US-6613772-B1 Drugs such as 2-(p-chlorophenyl-4-(4-hydroxybutyl)amino-6,7,8 -trimethoxyquinazoline used for activation of guanylate cyclase and modulation of cyclic guanosine monophosphate AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-09-02 — — US disclosed
CN-1422255-A Heterocycle derivatives and drugs NIPPON SHINYAKU CO LTD (JP) 2003-06-04 — — CN disclosed
EP-1040101-A1 SUBSTITUTED 2-ARYL-4-AMINO-CHINAZOLINES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2000-10-04 — — EP disclosed
WO-1999032460-A1 SUBSTITUTED 2-ARYL-4-AMINO-CHINAZOLINES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-01 — — 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 (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-20060009645-A1 Naphthylene derivatives as cytochrome P450 inhibitors CYP1A1, CYP1A2, RARA TLR8 3958/4885TLR7 2595/4885ATM 4657/4885

“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.

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