SCHEMBL4904620

SCHEMBL4904620

Nc1ccccc1-c1ncco1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATAD2 Q6PL18 1/20 0.46
BRD4 O60885 1/20 0.45
HPGDS O60760 1/20 0.44
LTA4H P09960 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADRA1A P35348 3/20 0.41
ADRA2A P08913 2/20 0.41
ADRA1D P25100 2/20 0.41
ADRA1B P35368 1/20 0.41
PIN1 Q13526 1/20 0.41
HSD17B10 Q99714 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL1919495 0.85 HPGDS (0.52) BRD4HPGDSLTA4HADRA1AADRA2A
SCHEMBL7256620 0.79 BRD4 (0.39) ATAD2BRD4HPGDSLTA4HHPGD
SCHEMBL30792106 0.78 MAP4K4 (0.44) BRD4HPGDSLTA4HADRA1AADRA2A
SCHEMBL9151503 0.78 LTA4H (0.46) ALDH1A1BRD4HPGDSLTA4HKDM4E
SCHEMBL24026461 0.78 TUBB4A (0.40) ALDH1A1BRD4HPGDSLTA4HKDM4E
SCHEMBL543874 0.78 HPGDS (0.42) ALDH1A1BRD4HPGDSLTA4HKDM4E
SCHEMBL11363800 0.77 BRD4 (0.57) ALDH1A1BRD4HPGDSLTA4HKDM4E
SCHEMBL26259967 0.77 BRD4 (0.53) ALDH1A1L3MBTL1BRD4HPGDSLTA4H
SCHEMBL3980022 0.76 NOTUM (0.52) ALDH1A1L3MBTL1BRD4HPGDSLTA4H
SCHEMBL243773 0.76 CASP3 (0.47) ALDH1A1BRD4HPGDSLTA4HKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109320507-B Chiral fluorescent compound based on quinoline amide folder and preparation method and application thereof 北京师范大学 2020-05-22 CN claimed
CN-109320507-A Chiral fluorescent chemicals and the preparation method and application thereof based on quinoline amides folded formation 北京师范大学 2019-02-12 CN claimed
US-11524943-B1 Benzocarbonyl compounds VIVACE THERAPEUTICS, INC. (US) 2022-12-13 US disclosed
CN-114846013-A Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof 株式会社LG化学 2022-08-02 CN disclosed
CN-113271941-A Urea derivatives for the treatment and/or prevention of cancer 法国国家科学研究中心 2021-08-17 CN disclosed
CN-109320507-B Chiral fluorescent compound based on quinoline amide folder and preparation method and application thereof 北京师范大学 2020-05-22 CN disclosed
WO-2019113236-A1 BENZOCARBONYL COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2019-06-13 WO disclosed
CN-109320507-A Chiral fluorescent chemicals and the preparation method and application thereof based on quinoline amides folded formation 北京师范大学 2019-02-12 CN disclosed
US-9580439-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2017-02-28 US disclosed
US-9580439-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2017-02-28 US disclosed
CN-101316853-B Benzothiazole and thiazolopyridine as SIRTUIN modulators SIRTRIS PHARMACEUTICALS INC 2014-09-24 CN disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0083975-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-19 EP disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
US-4602940-A HERBICIDES, PLANT GROWTH REGULATOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-07-29 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
US-4534790-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-08-13 US disclosed
US-4465505-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-08-14 US disclosed
EP-0083975-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-20 EP 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-11524943-B1 Benzocarbonyl compounds YAP1, TEAD2, TEAD3 ALDH1A1 2574/4885L3MBTL1 1795/4885ATAD2 889/4885

“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.