SCHEMBL1253013

SCHEMBL1253013

O=C(O)CCc1cc(=O)[nH]c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
KMT2A Q03164 7/20 0.56
KDM4E B2RXH2 6/20 0.56
MEN1 O00255 5/20 0.56
HPGD P15428 2/20 0.53
MITF O75030 1/20 0.53
TSHR P16473 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
EGFR P00533 1/20 0.52
SRC P12931 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.50
HTT P42858 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
SCHEMBL29443924 1.00 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL9155520 0.91 EGFR (0.55) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL9160532 0.90 KMT2A (0.52) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL8366302 0.84 ALDH1A1 (0.59) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL31376496 0.84 ALDH1A1 (0.59) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL29063256 0.82 EGFR (0.56) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL9766051 0.82 ALDH1A1 (0.62) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL8707975 0.81 HPGD (0.51) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL30175797 0.81 ALDH1A1 (0.55) ALDH1A1KMT2AKDM4EMEN1HPGD
SCHEMBL30430848 0.80 ALDH1A1 (0.67) ALDH1A1KMT2AKDM4EMEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 CN disclosed
CN-114588156-A Ophthalmic preparation and application thereof in treating presbyopia 温州医科大学附属眼视光医院 2022-06-07 CN disclosed
US-11318095-B2 Micelle for solubilizing a sparingly water-soluble ingredient and solution comprising the same TEIKA PHARMACEUTICAL CO., LTD. (JP) 2022-05-03 US disclosed
US-20210137836-A1 MICELLE FOR SOLUBILIZING A SPARINGLY WATER-SOLUBLE INGREDIENT AND SOLUTION COMPRISING THE SAME TEIKA PHARMACEUTICAL CO., LTD. (JP) 2021-05-13 US disclosed
CN-1934086-B Amine salt of carbostyril derivative OTSUKA PHARMA CO LTD 2013-01-02 CN disclosed
US-7879877-B2 orally administering 2-(4-chlorobenzoylamino)-3-(2-quinolon-4-yl)propionic acid, for the prophylaxis and/or treatment of xerostomia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-02-01 US disclosed
US-20070112026-A1 Carbostyril derivatives for accelerating salivation OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-05-17 US disclosed
EP-1706383-A1 AMINE SALT OF CARBOSTYRIL DERIVATIVE Otsuka Pharmaceutical Company, Limited (JP) 2006-10-04 EP disclosed
WO-2005070892-A1 AMINE SALT OF CARBOSTYRIL DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-08-04 WO disclosed
CN-1073418-C Interleukin-8 production inhibitor 大塚制药株式会社 2001-10-24 CN disclosed
US-4138490-A Analgesic compositions containing 1,2-dihydro-2-oxoquinol-4-ylpropionic acid derivatives IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-02-06 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 (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-20210137836-A1 MICELLE FOR SOLUBILIZING A SPARINGLY WATER-SOLUBLE INGREDIENT AND SOLUTION COMPRISING THE SAME CETP, LIPA, MUC1 ALDH1A1 4658/4885KMT2A 3708/4885KDM4E 4309/4885
US-11318095-B2 Micelle for solubilizing a sparingly water-soluble ingredient and solution comprising the same CETP, LIPA, MUC1 ALDH1A1 4658/4885KMT2A 3708/4885KDM4E 4309/4885
US-20070112026-A1 Carbostyril derivatives for accelerating salivation TAS2R40, TAS2R41, TAS2R42 ALDH1A1 3460/4885KMT2A 3304/4885KDM4E 3504/4885

“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.