SCHEMBL409672

SCHEMBL409672

Cc1ccc(C([O])=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.65
CES2 O00748 3/20 0.65
CES1 P23141 3/20 0.65
LMNA P02545 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.62
TDP1 Q9NUW8 4/20 0.56
HTT P42858 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
PKM P14618 3/20 0.56
KMT2A Q03164 3/20 0.56
ATM Q13315 2/20 0.56
HPGD P15428 2/20 0.56
MEN1 O00255 2/20 0.56
NLRP1 Q9C000 1/20 0.56
GAA P10253 1/20 0.56
NTSR1 P30989 1/20 0.56
SRD5A2 P31213 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
GSK3B P49841 1/20 0.52

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
Succinic Acid SCHEMBL27979899 0.86 KMT2A (0.70) ALDH1A1CES2CES1LMNASMN1; SMN2
P-Xylene SCHEMBL14721484 0.81 ALDH1A1 (0.67) ALDH1A1CES2CES1LMNASMN1; SMN2
P-Xylene SCHEMBL27538150 0.81 ALDH1A1 (0.67) ALDH1A1CES2CES1LMNASMN1; SMN2
4-Methylbenzoic Acid SCHEMBL7261856 0.80 ALDH1A1 (0.94) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL52200 0.79 ALDH1A1 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL167254 0.79 CES2 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL822185 0.79 ALDH1A1 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
4-Methylbenzoic Acid SCHEMBL30415250 0.78 ALDH1A1 (0.59) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL7218812 0.78 CES2 (0.75) ALDH1A1CES2CES1LMNASMN1; SMN2
Terephthalic Acid SCHEMBL526449 0.77 ALDH1A1 (1.00) ALDH1A1CES2CES1LMNASMN1; 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 861 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9884882-B2 Method for producing thiolane skeleton-type glycoconjugate, and thiolane skeleton-type glycoconjugate FUJIFILM CORPORATION (JP) 2018-02-06 US claimed
EP-3109245-B1 METHOD FOR PRODUCTING THIOLANE SKELETON-TYPE GLYCOCONJUGATE, AND THIOLANE SKELETON-TYPE GLYCOCONJUGATE FUJIFILM CORP (JP) 2018-01-03 EP claimed
EP-3109245-A1 METHOD FOR PRODUCTING THIOLANE SKELETON-TYPE GLYCOCONJUGATE, AND THIOLANE SKELETON-TYPE GLYCOCONJUGATE FUJIFILM Corporation (JP) 2016-12-28 EP claimed
US-20160355536-A1 METHOD FOR PRODUCING THIOLANE SKELETON-TYPE GLYCOCONJUGATE, AND THIOLANE SKELETON-TYPE GLYCOCONJUGATE FUJIFILM CORPORATION (JP) 2016-12-08 US 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
US-6933296-B2 Compounds effective as β2-adrenoreceptor agonists as well as PDE4-inhibitors ALTANA PHARMA B.V. (NL) 2005-08-23 US claimed
US-4619992-A IMPROVED COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1986-10-28 US claimed
EP-0157420-A2 Amide derivatives and 5-lipoxygenase inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-10-09 EP claimed
US-4496480-A Isothiazolazo dyes having coupling components which are free from unsaturated aliphatic radicals BASF AKTIENGESELLSCHAFT (DE) 1985-01-29 US claimed
US-4416879-A CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-22 US claimed
US-4385182-A SENSITIZERS OR PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1983-05-24 US claimed
US-4188388-A Phenoxy pyridazinones and anorexigenic use thereof ALBERT ROLLAND S.A. (FR) 1980-02-12 US claimed
US-4161598-A ANALGESICS, NARCOTIC ANTAGONISTS STERLING DRUG INC. (US) 1979-07-17 US claimed
US-4096143-A Process for producing phthalazinone and derivatives of the same FUJI PHOTO FILM CO., LTD. (JA) 1978-06-20 US claimed
US-4089865-A Certain thiazole compounds SYNTEX (U.S.A.) INC. (US) 1978-05-16 US claimed
US-4086423-A CEPHALOSPORINS, CYCLOADDITION OF GLYCINE DERIVATIVE TO THIAZINE COMPOUND MERCK & CO., INC. (US) 1978-04-25 US 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 ALDH1A1 24/4885CES2 1061/4885CES1 1114/4885
US-20110184173-A1 Pyripyropene Derivatives Having An ACAT2-Inhibiting Activity ACAT2, ACAT1, AGPAT2 ALDH1A1 1202/4885CES2 953/4885CES1 144/4885
US-20160355536-A1 METHOD FOR PRODUCING THIOLANE SKELETON-TYPE GLYCOCONJUGATE, AND THIOLANE SKELETON-TYPE GLYCOCONJUGATE ST6GAL1, FUT6, FUT5 ALDH1A1 423/4885CES2 699/4885CES1 921/4885

“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.