SCHEMBL3166753

SCHEMBL3166753

COc1cc2ncnc(N)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.57
MAP4K4 O95819 3/20 0.55
ENPP1 P22413 2/20 0.53
KIT P10721 2/20 0.52
RET P07949 2/20 0.52
KDR P35968 2/20 0.52
LCK P06239 2/20 0.51
EGFR P00533 5/20 0.50
LMNA P02545 1/20 0.50
GLA P06280 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
SMARCA2 P51531 1/20 0.50
KMT2A Q03164 1/20 0.50
GAK O14976 1/20 0.50
SRC P12931 1/20 0.50
PI4KA P42356 1/20 0.50
PI4K2B Q8TCG2 1/20 0.50
PI4K2A Q9BTU6 1/20 0.50
PI4KB Q9UBF8 1/20 0.50

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
SCHEMBL30103402 1.00 PDE5A (0.57) PDE5AMAP4K4ENPP1KITRET
SCHEMBL15127844 0.90 ENPP1 (0.68) PDE5AMAP4K4ENPP1KITRET
SCHEMBL29761271 0.89 MAP4K4 (0.52) PDE5AMAP4K4ENPP1KITRET
SCHEMBL160593 0.89 MAP4K4 (0.52) PDE5AMAP4K4ENPP1KITRET
SCHEMBL24355412 0.87 GAK (0.56) ENPP1KDREGFRGAK
SCHEMBL8230611 0.86 EGFR (0.51) PDE5AMAP4K4RETKDRLCK
SCHEMBL4417590 0.86 PDE5A (0.51) PDE5AMAP4K4RETKDRLCK
SCHEMBL17661304 0.86 PDE5A (0.51) PDE5AMAP4K4KITRETKDR
SCHEMBL30968992 0.86 EGFR (0.51) PDE5AMAP4K4RETKDRLCK
SCHEMBL4424669 0.84 KDR (0.56) MAP4K4ENPP1KITRETKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111065635-B Novel pyrimidine derivatives as MTH1 inhibitors 无锡安万生物科技有限公司 2022-07-22 CN claimed
CN-113149969-A Andrographolide derivative with antitumor activity and preparation method thereof 籍建亚 2021-07-23 CN claimed
CN-111087351-A Synthetic method of erlotinib intermediate 山东罗欣药业集团股份有限公司 2020-05-01 CN claimed
CN-104725364-B The amine derivative of 6,7 dimethoxyquinazoline 4, its preparation method and medical usage 江苏省中国科学院植物研究所 2017-09-15 CN claimed
EP-0892790-A1 NEW QUINAZOLINE-4-AMINO-2-(PIPERIDINE-1-YL-4-SUBSTITUTED) DERIVATIVES HAVING ANTI-HYPERTENSIVE ACTIVITY, A METHOD FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1999-01-27 EP claimed
WO-1997037979-A1 NEW QUINAZOLINE-4-AMINO-2-(PIPERIDINE-1-YL-4-SUBSTITUTED) DERIVATIVES HAVING ANTI-HYPERTENSIVE ACTIVITY, A METHOD FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1997-10-16 WO claimed
EP-0225866-B1 QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE Gerot-Pharmazeutika Gesellschaft m.b.H. (AT) 1991-09-25 EP claimed
EP-0004389-B1 4-AMINO-6,7-DIMETHOXY QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AND A PHARMACEUTICAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-04-07 EP claimed
EP-0039190-A1 2-(1-Piperazinyl)-4-pyrimidinamines and related compounds AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-04 EP claimed
EP-0004389-A2 4-Amino-6,7-dimethoxy quinazoline derivatives, process for their preparation, their use and a pharmaceutical composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-10-03 EP claimed
WO-2024194756-A1 MODULATING THE INNATE IMMUNITY OF RNA PFIZER INC. (US) 2024-09-26 WO disclosed
CN-118141921-A Use of CAMK2 inhibitors for the preparation of a medicament for reducing resistance to EGFR-driven cancers 四川大学 2024-06-07 CN disclosed
EP-4248975-A2 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME Rigel Pharmaceuticals, Inc. (US) 2023-09-27 EP disclosed
US-20230293533-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. 2023-09-21 US disclosed
US-11723908-B2 Quinazoline derivatives as antitumor agents SUZHOU ZANRONG PHARMA LIMITED (CN) 2023-08-15 US disclosed
EP-0030156-A1 Quinazoline derivatives, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-06-10 EP disclosed
EP-0004389-A2 4-Amino-6,7-dimethoxy quinazoline derivatives, process for their preparation, their use and a pharmaceutical composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-10-03 EP disclosed
EP-0004389-A2 4-Amino-6,7-dimethoxy quinazoline derivatives, process for their preparation, their use and a pharmaceutical composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-10-03 EP disclosed
EP-0004389-A2 4-Amino-6,7-dimethoxy quinazoline derivatives, process for their preparation, their use and a pharmaceutical composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-10-03 EP disclosed
US-3800039-A ANTITHROMBOGENIC PROCESS EMPLOYING SUBSTITUTED 6,7-DIALKOXYQUINAZOLINES MEAD JOHNSON & CO 1974-03-26 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-11723908-B2 Quinazoline derivatives as antitumor agents ABL1, TP53, JAK1 PDE5A 3374/4885MAP4K4 72/4885ENPP1 2020/4885
US-20230293533-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ABL1, TP53, JAK1 PDE5A 3374/4885MAP4K4 72/4885ENPP1 2020/4885

“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.