SCHEMBL4918873

SCHEMBL4918873

c1ccc2nc3c(cc2c1)O3

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
GLA P06280 2/20 0.54
MAPT P10636 2/20 0.54
ACHE P22303 1/20 0.54
DHODH Q02127 1/20 0.43
CYP1A2 P05177 1/20 0.42
NQO2 P16083 1/20 0.41
KDM4E B2RXH2 4/20 0.41
GAA P10253 3/20 0.41
HTR3A P46098 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
STAT3 P40763 1/20 0.41
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
PTBP1 P26599 1/20 0.39
RAB9A P51151 1/20 0.39
RCE1 Q9Y256 1/20 0.39

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
Acridine SCHEMBL4972293 0.72 ALDH1A1 (1.00) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL1772714 0.72 ALDH1A1 (1.00) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL3045498 0.72 ALDH1A1 (1.00) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL8339 0.72 ALDH1A1 (1.00) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL29352289 0.72 ALDH1A1 (1.00) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL641951 0.69 ALDH1A1 (0.94) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL1551975 0.69 ALDH1A1 (0.94) ALDH1A1HPGDGLAMAPTACHE
Acridine SCHEMBL10801271 0.69 ALDH1A1 (0.94) ALDH1A1HPGDGLAMAPTACHE
Anthracene SCHEMBL9879830 0.69 MAPT (0.94) ALDH1A1HPGDGLAMAPTACHE
SCHEMBL5469928 0.69 MAPT (0.82) ALDH1A1HPGDGLAMAPTACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551862-B Macrocyclic inhibitors of peptidyl arginine deiminase 吉利德科学公司 2024-04-12 CN disclosed
WO-2023116804-A1 LIPID COMPOUND AND LIPID NANOPARTICLE COMPOSITION 苏州艾博生物科技有限公司 2023-06-29 WO disclosed
CN-108623619-B Process for preparing C-Met tyrosine kinase inhibitors 江苏豪森药业集团有限公司 2021-11-05 CN disclosed
CN-113412542-A Color-tunable LED-OLED hybrid guided lighting device 李坚 2021-09-17 CN disclosed
CN-109053699-A A kind of preparation method of cycolxylidin 四川和邦生物科技股份有限公司 2018-12-21 CN disclosed
CN-105481839-B A kind of preparation method of photolytic activity epoxy quinoline enantiomer 安徽千和新材料科技发展有限公司 2018-05-11 CN disclosed
CN-105367557-B A kind of preparation method of epoxy quinoline 安徽千和新材料科技发展有限公司 2018-04-24 CN disclosed
CN-107735880-A Efficient O L ED device with extremely short decay time UDC 爱尔兰有限责任公司 2018-02-23 CN disclosed
CN-105481839-A Preparation method for cycloxylidin enantiomer with photoactivity ANHUI QIANHE NEW MAT SCIENCE & TECH DEV CO LTD 2016-04-13 CN disclosed
CN-105367557-A Method for preparing cycloxylidin ANHUI QIANHE NEW MAT SCIENCE & TECH DEV CO LTD 2016-03-02 CN disclosed
US-20080312185-A1 SUBSTITUTED 3-AMINO-THIENO[2,3-b]PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AND PROCESSES FOR PREPARING AND THEIR USES CHEN ZHIDONG 2008-12-18 US disclosed
US-20060270671-A1 Substituted 3-amino-thieno[2,3-b] pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-11-30 US disclosed
US-7119102-B2 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-10-10 US disclosed
EP-1692141-A1 SUBSTITUTED 3-AMINO-THIENO¬2,3-B| PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AS IKK INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2006-08-23 EP disclosed
US-20050182053-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-08-18 US disclosed
WO-2005056562-A1 SUBSTITUTED 3-AMINO-THIENO[2,3-B] PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AS IKK INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-06-23 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 (3 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-20050182053-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, IKBKG, IKBKE ALDH1A1 3655/4885HPGD 2067/4885GLA 3410/4885
US-20060270671-A1 Substituted 3-amino-thieno[2,3-b] pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses CPS1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TK2 ALDH1A1 371/4885HPGD 869/4885GLA 1173/4885
US-20080312185-A1 SUBSTITUTED 3-AMINO-THIENO[2,3-b]PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AND PROCESSES FOR PREPARING AND THEIR USES CPS1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TK2 ALDH1A1 371/4885HPGD 869/4885GLA 1173/4885

“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.