SCHEMBL7863830

SCHEMBL7863830

O=C(OCc1ccccc1)c1ccco1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.61
TDP1 Q9NUW8 3/20 0.61
SLC6A2 P23975 1/20 0.61
SLC6A3 Q01959 1/20 0.61
ALDH1A1 P00352 9/20 0.61
HPGD P15428 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
TSHR P16473 3/20 0.58
LMNA P02545 4/20 0.57
MEN1 O00255 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KDM4E B2RXH2 1/20 0.55
HTT P42858 1/20 0.53

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
SCHEMBL27624339 0.92 ALDH1A1 (0.62) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL31571742 0.84 ALDH1A1 (0.63) KMT2ATDP1ALDH1A1HPGDNPSR1
SCHEMBL11608575 0.84 ALDH1A1 (0.57) KMT2AALDH1A1HPGDNPSR1TSHR
SCHEMBL179961 0.84 ALDH1A1 (0.64) KMT2ATDP1ALDH1A1HPGDNPSR1
SCHEMBL11039202 0.82 ALDH1A1 (0.62) KMT2AALDH1A1HPGDTSHRLMNA
SCHEMBL7636627 0.82 CES2 (0.57) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL30452406 0.82 ALDH1A1 (0.55) KMT2ATDP1ALDH1A1HPGDNPSR1
SCHEMBL1532806 0.82 ALDH1A1 (0.62) KMT2ATDP1ALDH1A1HPGDNPSR1
SCHEMBL12175591 0.82 ALDH1A1 (0.50) KMT2AALDH1A1HPGDNPSR1TSHR
SCHEMBL31757952 0.81 KMT2A (0.66) KMT2AALDH1A1HPGDTSHRLMNA

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-119930868-A Catalyst component containing furoic acid ester compound, preparation method thereof, olefin polymerization catalyst, olefin polymerization method and olefin polymer 中国石油化工股份有限公司 2025-05-06 CN claimed
WO-2001019185-A2 METHODS FOR CONTROLLING A PEST POPULATION SUMMUS GROUP, LTD. (US) 2001-03-22 WO claimed
CN-115093355-B Preparation method of pyrrole ester compound 河南农业大学 2024-06-04 CN disclosed
CN-115093355-A Preparation method of pyrrole ester compound 河南农业大学 2022-09-23 CN disclosed
WO-2019002074-A1 THIAZOLE COMPOUNDS USEFUL AS PRMT5 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2019-01-03 WO disclosed
CN-102822154-B Heteroarylcarboxylicacid acid ester derivative AJINOMOTO CO.,INC. (JP) 2016-06-01 CN disclosed
US-9018259-B2 Treatment of cancer using benzoic acid derivatives NEW YORK UNIVERSITY (US) 2015-04-28 US disclosed
CN-103254028-A Method for synthesizing carboxylic acid by removing benzyl protection of benzyl carboxylate UNIV CHONGQING 2013-08-21 CN disclosed
US-20120329861-A1 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES NEW YORK UNIVERSITY (US) 2012-12-27 US disclosed
CN-102822154-A Heteroarylcarboxylic acid ester derivative AJINOMOTO KK 2012-12-12 CN disclosed
US-4305872-A HYPOTHALAMIC RELEASING AND INHIBITORY FACTORS, ENKEPHALINS AND ANTAGONISTS TO PRECURSOR PEPTIDES USEFUL IN BIOASSAY Wingrove, Kenneth (US) 1981-12-15 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 (1 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-20120329861-A1 TREATMENT OF CANCER USING BENZOIC ACID DERIVATIVES AHR, TYR, CYP4X1 KMT2A 2450/4885TDP1 950/4885SLC6A2 928/4885

“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.