SCHEMBL49951

SCHEMBL49951

Cc1ccccc1C([O])=O

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
ERCC5 P28715 1/20 0.50
FEN1 P39748 1/20 0.50
KMT2A Q03164 1/20 0.50
HTT P42858 1/20 0.48
TSHR P16473 2/20 0.48
MAPK1 P28482 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MYC P01106 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 1/20 0.46
ELANE P08246 1/20 0.46

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
SCHEMBL29425530 0.81 HPGD (0.54) HPGDERCC5FEN1HTTTSHR
SCHEMBL166603 0.81 HPGD (0.54) HPGDERCC5FEN1HTTTSHR
SCHEMBL333141 0.81 CYP3A4 (0.55) HPGDERCC5FEN1KMT2AHTT
SCHEMBL29387256 0.81 CYP3A4 (0.55) HPGDERCC5FEN1KMT2AHTT
SCHEMBL501719 0.80 ESR1 (0.50) HPGDKMT2AHTTTSHRNPC1
SCHEMBL4652941 0.80 ALDH1A1 (0.56) HPGDTSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL10669335 0.79 CYP3A4 (0.59) HPGDERCC5FEN1KMT2AHTT
Toluic Acid SCHEMBL148201 0.79 ALDH1A1 (0.65) HPGDERCC5FEN1KMT2ASMN1; SMN2
SCHEMBL112406 0.79 HPGD (0.57) HPGDERCC5FEN1HTTNPC1
Toluic Acid SCHEMBL4152 0.79 ALDH1A1 (0.65) HPGDERCC5FEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4265602-A2 LEOLIGIN DERIVATIVES AS PROLIFERATION INHIBITORS OF SMOOTH MUSCLE CELLS TECHNISCHE UNIVERSITÄT WIEN (AT) 2023-10-25 EP claimed
EP-2697206-B1 HETEROCYCLIC COMPOUNDS AND USES THEREOF IN THE TREATMENT OF SEXUAL DISORDERS ATIR HOLDING S A (LU) 2019-04-03 EP claimed
US-20170157301-A1 LEOLIGIN DERIVATIVES AS SMOOTH MUSCLE CELL PROLIFERATION INHIBITORS TECHNISCHE UNIVERSITÄET WIEN (AT) 2017-06-08 US claimed
EP-3160462-A1 LEOLIGIN DERIVATIVES AS SMOOTH MUSCLE CELL PROLIFERATION INHIBITORS Technische Universität Wien (AT) 2017-05-03 EP claimed
WO-2015196228-A1 LEOLIGIN DERIVATIVES AS SMOOTH MUSCLE CELL PROLIFERATION INHIBITORS TECHNISCHE UNIVERSITÄT WIEN (AT) 2015-12-30 WO claimed
US-20150322094-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2015-11-12 US claimed
EP-2892343-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS Bayer CropScience AG (DE) 2015-07-15 EP claimed
WO-2014037349-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2014-03-13 WO claimed
US-20110184173-A1 Pyripyropene Derivatives Having An ACAT2-Inhibiting Activity THE KITASATO INSTITUTE (JP) 2011-07-28 US claimed
EP-2228376-A1 PYRIPYROPENE DERIVATIVE HAVING ACAT2-INHIBITING ACTIVITY The Kitasato Institute (JP) 2010-09-15 EP claimed
EP-0351336-B1 PROCESS FOR THE PREPARATION OF HYDROXYBENZALDEHYDES BY HYDROCARBONYLATION RHONE-POULENC CHIMIE (FR) 1992-10-28 EP claimed
US-5101032-A Sensitizers for photopolymerization and electrography BASF AKTIENGESELLSCHAFT (DE) 1992-03-31 US claimed
US-4933497-A Preparation of hydroxybenzaldehydes by hydrocarbonylation of halophenols RHONE-POULENC CHIMIE (FR) 1990-06-12 US claimed
EP-0351336-A1 Process for the preparation of hydroxybenzaldehydes by hydrocarbonylation RHONE-POULENC CHIMIE (FR) 1990-01-17 EP claimed
EP-0331593-A1 Process for the preparation of hydroxybenzaldehydes by hydrocarbonylation RHONE-POULENC CHIMIE (FR) 1989-09-06 EP claimed
US-4291047-A Combating fungi with α-azolyl-β-hydroxy-ketones BAYER AKTIENGESELLSCHAFT (DE) 1981-09-22 US claimed
EP-0004727-B1 BLOOD PLATELET AGGREGATION INHIBITORY PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESSES FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-08-12 EP claimed
US-4268510-A DEMETHANIZATION, METABOLISM, RUMEN IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-05-19 US claimed
EP-0010348-A1 Heterocyclic trichloromethyl derivatives, process for their preparation and their use IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-04-30 EP claimed
EP-0004727-A2 Blood platelet aggregation inhibitory pyridine derivatives, pharmaceutical compositions thereof, and processes for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-10-17 EP claimed

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-20150322094-A1 USE OF SUBSTITUTED 2,3-DIHYDRO-1-BENZOFURAN-4-CARBOXYLIC ACIDS OR SALTS THEREOF AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS CAT, HSF1, HPD HPGD 205/4885ERCC5 3637/4885FEN1 3593/4885
US-20110184173-A1 Pyripyropene Derivatives Having An ACAT2-Inhibiting Activity ACAT2, ACAT1, AGPAT2 HPGD 1060/4885ERCC5 4866/4885FEN1 3500/4885
US-20170157301-A1 LEOLIGIN DERIVATIVES AS SMOOTH MUSCLE CELL PROLIFERATION INHIBITORS CCNH, MYLK, CCAR2 HPGD 2024/4885ERCC5 2546/4885FEN1 4333/4885

“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.