SCHEMBL480278

SCHEMBL480278

O=C1c2ccccc2C(=O)N1Cc1ccco1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.73
KDM4E B2RXH2 1/20 0.73
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
MAPT P10636 2/20 0.62
PKM P14618 2/20 0.62
RGS12 O14924 1/20 0.62
USP2 O75604 1/20 0.62
POLB P06746 1/20 0.62
RECQL P46063 1/20 0.62
CACNA1B Q00975 1/20 0.62
APBA1 Q02410 1/20 0.62
KEAP1 Q14145 1/20 0.62
NFE2L2 Q16236 1/20 0.62
TSHR P16473 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
HPGD P15428 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
GAA P10253 3/20 0.56

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
SCHEMBL4094368 0.85 ALDH1A1 (1.00) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL28960465 0.82 ALDH1A1 (0.60) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL4625771 0.82 CES1 (0.59) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL12176977 0.81 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL13401392 0.79 ALDH1A1 (0.86) ALDH1A1MEN1KMT2AL3MBTL1MAPT
SCHEMBL11377406 0.78 HPGD (0.61) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL28960488 0.78 KMT2A (0.67) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL11373726 0.77 HPGD (0.63) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL2795967 0.77 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16047533 0.77 ALDH1A1 (0.58) ALDH1A1KDM4EMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9143159-A None JP disclosed
JP-9087248-A None JP disclosed
US-10653676-B2 Small molecule inhibitors of USP1 deubiquitinating enzyme activity DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-05-19 US disclosed
US-20170202810-A1 SMALL MOLECULE INHIBITORS OF USP1 DEUBIQUITINATING ENZYME ACTIVITY DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-07-20 US disclosed
US-9518032-B2 Small molecule inhibitors of USP1 deubiquitinating enzyme activity DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-12-13 US disclosed
US-20130253005-A1 SMALL MOLECULE INHIBITORS OF USP1 DEUBIQUITINATING ENZYME ACTIVITY THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2013-09-26 US disclosed
US-8440672-B2 Diphenyl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
US-8440672-B2 Diphenyl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
EP-2013174-B1 DIARYL SUBSTITUTED ALKANES MERCK SHARP & DOHME (US) 2013-05-08 EP disclosed
EP-2013174-B1 DIARYL SUBSTITUTED ALKANES MERCK SHARP & DOHME (US) 2013-05-08 EP disclosed
EP-0668256-B1 Process for preparing a water-soluble organic oxide COSMO SOGO KENKYUSHO KK (JP) 1997-10-15 EP disclosed
JP-H09143159-A PRODUCTION OF 5-PHTHALIMIDO-4-OXOPENTENOIC ACID PYRIDINE SALT COSMO SOGO KENKYUSHO:KK 1997-06-03 JP disclosed
JP-H0987248-A PRODUCTION OF 5-PHTHALIMIDO-4-OXOPENTENOIC ACID OR ITS PYRIDINE SLAT COSMO SOGO KENKYUSHO:KK 1997-03-31 JP disclosed
EP-0607952-B1 Process for preparing 5-aminolevulinic acid COSMO SOGO KENKYUSHO KK (JP) 1996-12-04 EP disclosed
US-5554766-A OXIATION COSMO RESEARCH INSTITUTE (JP) 1996-09-10 US disclosed
EP-0668256-A1 Process for preparing water-soluble organic oxides such as 5-aminolevulinic acid COSMO RESEARCH INSTITUTE (JP) 1995-08-23 EP disclosed
US-5380935-A Process for preparing 5-aminolevulinic acid COSMO RESEARCH INSTITUTE (JP) 1995-01-10 US disclosed
EP-0607952-A1 Process for preparing 5-aminolevulinic acid COSMO RESEARCH INSTITUTE (JP) 1994-07-27 EP disclosed
EP-0523846-A2 1,4-Benzodiazepines with 5-membered heterocyclic rings MERCK & CO. INC. (US) 1993-01-20 EP disclosed
EP-0272866-A1 1,4-Benzodiazepines with 5-membered heterocyclic rings MERCK & CO. INC. (US) 1988-06-29 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 (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-20130253005-A1 SMALL MOLECULE INHIBITORS OF USP1 DEUBIQUITINATING ENZYME ACTIVITY USP1, USP2, USP28 ALDH1A1 1183/4885KDM4E 934/4885MEN1 2034/4885
US-10653676-B2 Small molecule inhibitors of USP1 deubiquitinating enzyme activity USP1, USP2, USP28 ALDH1A1 1183/4885KDM4E 934/4885MEN1 2034/4885
US-20170202810-A1 SMALL MOLECULE INHIBITORS OF USP1 DEUBIQUITINATING ENZYME ACTIVITY USP1, USP2, USP28 ALDH1A1 1183/4885KDM4E 934/4885MEN1 2034/4885

“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.