SCHEMBL548920

SCHEMBL548920

Cc1cccc(C([O])=O)c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.65
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 2/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KCNK3 O14649 2/20 0.55
KCNK9 Q9NPC2 2/20 0.55
KCNH2 Q12809 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
POLB P06746 2/20 0.53
ACHE P22303 1/20 0.50
NPC1 O15118 1/20 0.50
TP53 P04637 1/20 0.50
RAB9A P51151 1/20 0.50
RXFP1 Q9HBX9 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
SCHEMBL3753879 0.83 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL29503529 0.83 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL186545 0.83 PARP1 (0.68) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL14406 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL29382709 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL76212 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL142937 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL29639739 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
SCHEMBL15264066 0.81 PARP1 (0.65) PARP1HDAC8HDAC6SMN1; SMN2HPGD
Ammonia Solution, Strong SCHEMBL1667008 0.79 PARP1 (0.63) PARP1HDAC8HDAC6SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20030036661-A1 2-Aroyl-4-acyl paclitaxel (taxol) analogs BRISTOL-MYERS SQUIBB COMPANY 2003-02-20 US claimed
EP-1067923-A4 2-AROYL-4-ACYL PACLITAXEL (TAXOL) ANALOGS BRISTOL MYERS SQUIBB CO (US) 2002-11-13 EP claimed
EP-1067923-A1 2-AROYL-4-ACYL PACLITAXEL (TAXOL) ANALOGS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-01-17 EP claimed
WO-1999033462-A1 2-AROYL-4-ACYL PACLITAXEL (TAXOL) ANALOGS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1999-07-08 WO claimed
EP-0171064-B1 Azetidinone derivative and processes for production thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-07-12 EP claimed
EP-0249999-A2 Triazolyl ethyl ethers and fungicides containing them BASF Aktiengesellschaft (DE) 1987-12-23 EP claimed
US-11873468-B2 Polymers for the treatment of surfaces HENKEL AG & CO. KGAA (DE) 2024-01-16 US disclosed
US-11591426-B2 Copolymer, wetting agent, medical device, and method for producing same TORAY INDUSTRIES, INC. (JP) 2023-02-28 US disclosed
EP-3438144-B1 COPOLYMER, WETTING AGENT, MEDICAL DEVICE, AND METHOD FOR PRODUCING SAME TORAY INDUSTRIES (JP) 2021-06-30 EP disclosed
WO-2021029158-A1 SULFONAMIDE COMPOUND, NONIONIC PHOTOACID GENERATOR, AND PHOTOLITHOGRAPHY RESIN COMPOSITION サンアプロ株式会社 2021-02-18 WO disclosed
US-4847272-A ANTICOAGULANTS SANKYO COMPANY LIMITED (JP) 1989-07-11 US disclosed
EP-0249999-A2 Triazolyl ethyl ethers and fungicides containing them BASF Aktiengesellschaft (DE) 1987-12-23 EP disclosed
EP-0240107-A1 Thianaphthene derivatives, their production and use Sankyo Company Limited (JP) 1987-10-07 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 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-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 PARP1 3424/4885HDAC8 2868/4885HDAC6 1045/4885
US-20110184173-A1 Pyripyropene Derivatives Having An ACAT2-Inhibiting Activity ACAT2, ACAT1, AGPAT2 PARP1 4377/4885HDAC8 460/4885HDAC6 580/4885
US-20030036661-A1 2-Aroyl-4-acyl paclitaxel (taxol) analogs HDAC6, HDAC3, ACAT2 PARP1 25/4885HDAC8 29/4885HDAC6 1/4885

“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.