SCHEMBL8350546

SCHEMBL8350546

CNc1cccc(NC(N)=O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
GFER P55789 1/20 0.50
GPR35 Q9HC97 1/20 0.48
ALDH1A1 P00352 3/20 0.47
KCNK3 O14649 2/20 0.46
KCNK9 Q9NPC2 2/20 0.46
DDX3X O00571 1/20 0.46
PEPD P12955 1/20 0.45
PARP1 P09874 2/20 0.45
PARP10 Q53GL7 2/20 0.45
KIF11 P52732 2/20 0.45
PARP14 Q460N5 1/20 0.45
POLB P06746 1/20 0.44
NR4A1 P22736 1/20 0.44
RAB9A P51151 1/20 0.44
KCNH2 Q12809 1/20 0.44
CYP1A2 P05177 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL3690365 0.89 MAPT (0.59) GAAMAPTGFERGPR35ALDH1A1
SCHEMBL8885278 0.85 ALDH1A1 (0.52) GAAMAPTGFERALDH1A1DDX3X
SCHEMBL8532903 0.84 ALDH1A1 (0.67) MAPTALDH1A1POLBNR4A1RAB9A
SCHEMBL1487964 0.82 ALDH1A1 (0.66) MAPTALDH1A1POLBNR4A1RAB9A
SCHEMBL697192 0.82 GPR35 (0.55) MAPTGPR35ALDH1A1KCNK3KCNK9
SCHEMBL20714982 0.80 CYP1A2 (0.43) GPR35ALDH1A1KCNK3KCNK9DDX3X
SCHEMBL20057531 0.80 CYP1A2 (0.67) GAAMAPTALDH1A1CYP1A2HSD17B10
SCHEMBL22699676 0.80 MAPT (0.50) GAAMAPTGFERGPR35ALDH1A1
SCHEMBL16488795 0.80 MEN1 (0.51) MAPTGPR35ALDH1A1DDX3XPOLB
SCHEMBL166848 0.80 HSD17B10 (0.69) GAAALDH1A1KCNK3KCNK9RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357165-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-11-09 US disclosed
WO-2022003712-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2022-01-06 WO disclosed
EP-3180326-B1 BENZODIAZEPINE DERIVATIVES AS CCK2/GASTRIN RECEPTOR ANTAGONISTS TRIO MEDICINES LTD (GB) 2019-10-23 EP disclosed
US-10017481-B2 Conformationally constrained, fully synthetic macrocyclic compounds POLYPHOR AG (CH) 2018-07-10 US disclosed
US-9618867-B2 Pigment dispersion and toner CANON KABUSHIKI KAISHA (JP) 2017-04-11 US disclosed
US-20160246200-A1 PIGMENT DISPERSION AND TONER CANON KABUSHIKI KAISHA (JP) 2016-08-25 US disclosed
US-7329660-B2 Phthalazine derivatives for treating inflammatory diseases NOVARTIS AG (CH) 2008-02-12 US disclosed
US-7329660-B2 Phthalazine derivatives for treating inflammatory diseases NOVARTIS AG (CH) 2008-02-12 US disclosed
WO-2004058234-A2 PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2004-07-15 WO disclosed
CN-1075717-A Benzodiazepine * derivatives YAMANOUCHI PHARMA CO LTD (JP) 1993-09-01 CN 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-20230357165-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF ATG7, GOT1, LIPC GAA 313/4885MAPT 2243/4885GFER 3366/4885
US-10017481-B2 Conformationally constrained, fully synthetic macrocyclic compounds CTSE, CTSB, CTSS GAA 2400/4885MAPT 4679/4885GFER 1832/4885

“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.