SCHEMBL891658

SCHEMBL891658

COc1ccc(O)cc1CC(=O)O

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.70
GAA P10253 3/20 0.56
ALDH1A1 P00352 2/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CAMK2A Q9UQM7 3/20 0.51
TTR P02766 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KDM4E B2RXH2 2/20 0.48
ABL1 P00519 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
RECQL P46063 1/20 0.47
RIN1 Q13671 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
BACE1 P56817 1/20 0.47
MAOB P27338 1/20 0.46
EGFR P00533 1/20 0.45

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
SCHEMBL1099347 0.86 CAMK2A (0.64) HSD17B10GAAALDH1A1TSHRNFKB1
SCHEMBL28052432 0.86 CYP3A4 (0.62) HSD17B10GAAALDH1A1TTRKDM4E
SCHEMBL6036250 0.84 EGFR (0.55) HSD17B10GAAALDH1A1TDP1TTR
SCHEMBL27364715 0.82 CAMK2A (0.51) HSD17B10GAAALDH1A1TSHRNFKB1
SCHEMBL504029 0.82 HSD17B10 (1.00) HSD17B10GAAKDM4EABL1POLB
SCHEMBL30512021 0.82 HSD17B10 (1.00) HSD17B10GAAKDM4EABL1POLB
SCHEMBL6343545 0.82 HSD17B10 (0.70) HSD17B10GAAALDH1A1TSHRNFKB1
SCHEMBL29431167 0.82 HSD17B10 (0.70) HSD17B10GAAALDH1A1TSHRNFKB1
SCHEMBL13205866 0.82 HSD17B10 (0.70) HSD17B10GAAALDH1A1TSHRNFKB1
SCHEMBL29773177 0.82 HSD17B10 (0.70) HSD17B10GAAALDH1A1TSHRNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0021177-B1 MAYTANSINOIDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-02-08 EP claimed
US-4308268-A ANTITUMOR, ANTIMITOTIC, FUNGICIDES, ANTIPROTOZOA AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-12-29 US claimed
EP-0021177-A1 Maytansinoids, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP claimed
CN-109970542-B Application of quebrachitol in copper-catalyzed aryl halide hydrolysis reaction 沈阳药科大学 2021-06-11 CN disclosed
US-10329575-B2 Regulatory sequence for plants CERES, INC. (US) 2019-06-25 US disclosed
US-20180223303-A1 SEQUENCE-DETERMINED DNA FRAGMENTS AND CORRESPONDING POLYPEPTIDES ENCODED THEREBY CERES INC (US) 2018-08-09 US disclosed
US-20170037426-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby ALEXANDROV NICKOLAI (US) 2017-02-09 US disclosed
US-20160076046-A1 PROMOTER, PROMOTER CONTROL ELEMENTS, AND COMBINATIONS, AND USES THEREOF CERES, INC. (US) 2016-03-17 US disclosed
US-9029523-B2 Promoter, promoter control elements, and combinations, and uses thereof CERES, INC. (US) 2015-05-12 US disclosed
US-20150033417-A9 Promoter, promoter control elements, and combinations, and uses thereof ALEXANDROV NICKOLAI (US) 2015-01-29 US disclosed
US-8877916-B2 Promoter, promoter control elements, and combinations, and uses thereof CERES, INC. (US) 2014-11-04 US disclosed
US-20120084885-A1 Promoter, promoter control elements, and combinations, and uses thereof ALEXANDROV NICKOLAI (US) 2012-04-05 US disclosed
US-20110191912-A1 Promoter, promoter control elements, and combinations, and uses thereof ALEXANDROV NICKOLAI 2011-08-04 US disclosed
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed
US-20100037355-A1 SEQUENCE-DETERMINED DNA FRAGMENTS AND CORRESPONDING POLYPEPTIDES ENCODED THEREBY CERES, INC (US) 2010-02-11 US disclosed
US-20090265815-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded therapy ALEXANDROV NICKOLAI 2009-10-22 US disclosed
US-20070214517-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby CERES, INC. (US) 2007-09-13 US disclosed
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
US-20060150283-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby ALEXANDROV NICKOLAI 2006-07-06 US disclosed
US-20060048240-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby ALEXANDROV NICKOLAI 2006-03-02 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 (8 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-20170037426-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby RNGTT, CPSF1, CPSF6 HSD17B10 3481/4885GAA 1457/4885ALDH1A1 4769/4885
US-20150033417-A9 Promoter, promoter control elements, and combinations, and uses thereof RNGTT, GTF3C5, GTF3C1 HSD17B10 3406/4885GAA 1303/4885ALDH1A1 4635/4885
US-20120084885-A1 Promoter, promoter control elements, and combinations, and uses thereof RNGTT, GTF3C5, GTF3C1 HSD17B10 3420/4885GAA 1282/4885ALDH1A1 4633/4885
US-20070214517-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby RNGTT, CPSF1, CPSF6 HSD17B10 3481/4885GAA 1457/4885ALDH1A1 4769/4885
US-20110191912-A1 Promoter, promoter control elements, and combinations, and uses thereof RNGTT, GTF3C5, GTF3C1 HSD17B10 3406/4885GAA 1303/4885ALDH1A1 4635/4885
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 HSD17B10 204/4885GAA 815/4885ALDH1A1 1442/4885
US-20100037355-A1 SEQUENCE-DETERMINED DNA FRAGMENTS AND CORRESPONDING POLYPEPTIDES ENCODED THEREBY RNGTT, CPSF1, CPSF6 HSD17B10 3481/4885GAA 1457/4885ALDH1A1 4769/4885
US-20060048240-A1 Sequence-determined DNA fragments and corresponding polypeptides encoded thereby RNGTT, CPSF1, CPSF6 HSD17B10 3481/4885GAA 1457/4885ALDH1A1 4769/4885

“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.