SCHEMBL7044155

SCHEMBL7044155

CCCOc1ncc2ccccc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 5/20 0.51
GPBAR1 Q8TDU6 3/20 0.46
CYSLTR1 Q9Y271 2/20 0.46
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38
CYP1A2 P05177 2/20 0.38
HTR3A P46098 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
MAPK8 P45983 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
Hydrochloric Acid SCHEMBL27905861 0.98 TLR8 (0.50) TLR8GPBAR1CYSLTR1KDM4EALDH1A1
SCHEMBL22579036 0.90 TLR8 (0.54) TLR8GPBAR1CYSLTR1KDM4EALDH1A1
Phosphine SCHEMBL27716021 0.88 TLR8 (0.52) TLR8GPBAR1CYSLTR1KDM4EALDH1A1
SCHEMBL3433191 0.88 TLR8 (0.55) TLR8GPBAR1CYSLTR1KDM4EALDH1A1
SCHEMBL3634933 0.85 TLR8 (0.49) TLR8KDM4EALDH1A1GAAKMT2A
SCHEMBL30952029 0.85 TLR8 (0.49) TLR8KDM4EALDH1A1GAAKMT2A
SCHEMBL716117 0.84 TSHR (0.50) TLR8KDM4EALDH1A1HPGDCYP1A2
Hydrochloric Acid SCHEMBL27476977 0.83 TSHR (0.49) TLR8KDM4EALDH1A1HPGDCYP1A2
SCHEMBL28700302 0.82 KDM4E (0.37) TLR8CYSLTR1KDM4EALDH1A1MEN1
SCHEMBL28691857 0.82 KDM4E (0.37) TLR8CYSLTR1KDM4EALDH1A1MEN1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102850280-B 6,7-dialkyloxy-4-substituted phenylamino quinazoline compounds and preparation methods UNIV SHAANXI NORMAL 2015-06-10 CN claimed
CN-102850280-A 6,7-dialkyloxy-4-substituted phenylamino quinazoline compounds and preparation methods UNIV SHAANXI NORMAL 2013-01-02 CN claimed
EP-0873319-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1998-10-28 EP claimed
WO-1997022596-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-06-26 WO claimed
CN-120130476-A Application of diphenyl sulfide-containing compound in preventing and treating sunscald disease of crops 海利尔药业集团股份有限公司 2025-06-13 CN disclosed
CN-120130475-A Use of biphenyl sulfide-containing compound or composition thereof for improving stress resistance of plants 海利尔药业集团股份有限公司 2025-06-13 CN disclosed
CN-118318839-A Use of substituted phenylamide isoxazoline compound for controlling thysanoptera pests 海利尔药业集团股份有限公司 2024-07-12 CN disclosed
CN-118290356-A Substituted benzil isoxazoline compound and application of preparation containing substituted benzil isoxazoline compound in preventing and controlling harmful mites and reducing reproductive power of harmful mites 海利尔药业集团股份有限公司 2024-07-05 CN disclosed
CN-105294716-A Amino quinazoline derivative disalicylate and crystal form thereof RUYUAN YAO AUTONOMOUS COUNTY DAZHONG DRUG TRADING CO LTD 2016-02-03 CN disclosed
CN-102850280-B 6,7-dialkyloxy-4-substituted phenylamino quinazoline compounds and preparation methods UNIV SHAANXI NORMAL 2015-06-10 CN disclosed
CN-102850280-A 6,7-dialkyloxy-4-substituted phenylamino quinazoline compounds and preparation methods UNIV SHAANXI NORMAL 2013-01-02 CN disclosed
EP-1474420-A1 QUINAZOLINE COMPOUNDS Astrazeneca AB (SE) 2004-11-10 EP disclosed
WO-2003064413-A1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2003-08-07 WO disclosed