SCHEMBL790636

SCHEMBL790636

CC(S)Nc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.64
ALDH1A1 P00352 5/20 0.54
TSHR P16473 4/20 0.54
HSD17B10 Q99714 4/20 0.54
ALOX15 P16050 3/20 0.54
ALOX12 P18054 3/20 0.54
CYP3A4 P08684 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 2/20 0.54
THRB P10828 1/20 0.54
RECQL P46063 1/20 0.54
ATM Q13315 1/20 0.54
GAA P10253 2/20 0.47
MAPK1 P28482 2/20 0.45
HIF1A Q16665 1/20 0.45
KDM4E B2RXH2 1/20 0.42
KCNH3 Q9ULD8 1/20 0.42
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
CTSD P07339 1/20 0.41

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
SCHEMBL22648282 0.79 TDP1 (0.56) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL841689 0.78 TDP1 (0.70) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL66892 0.78 TDP1 (1.00) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL990038 0.78 TDP1 (0.70) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL18559184 0.77 MAPT (0.50) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL22648059 0.77 TDP1 (0.54) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL23319717 0.76 TDP1 (0.94) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL22710108 0.76 TDP1 (0.67) TDP1ALDH1A1TSHRHSD17B10ALOX15
Hydrochloric Acid SCHEMBL7407338 0.76 TDP1 (0.94) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL15212378 0.76 TDP1 (0.94) TDP1ALDH1A1TSHRHSD17B10ALOX15

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
US-11813295-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity Theobald Therapeutics LLC (US) 2023-11-14 US disclosed
US-20230136150-A1 Compositions for Inhibition of Insect Sensing UNIV VANDERBILT (US) 2023-05-04 US disclosed
US-10828356-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity BERMUDES DAVID GORDON (US) 2020-11-10 US disclosed
US-10729731-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity BERMUDES DAVID GORDON (US) 2020-08-04 US disclosed
US-20200199081-A1 STK19 INHIBITORS FOR TREATMENT OF CANCER TRUSTEES OF BOSTON UNIVERSITY (US) 2020-06-25 US disclosed
US-10449237-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity BERMUDES DAVID GORDON (US) 2019-10-22 US disclosed
US-10286051-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity BERMUDES DAVID GORDON (US) 2019-05-14 US disclosed
US-20180177767-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2018-06-28 US disclosed
US-9616114-B1 Modified bacteria having improved pharmacokinetics and tumor colonization enhancing antitumor activity BERMUDES DAVID GORDON (US) 2017-04-11 US disclosed
US-9249181-B2 C-terminal amidation of polypeptides AMYLIN PHARMACEUTICALS, LLC (US) 2016-02-02 US disclosed
WO-2012036962-A2 C-TERMINAL AMIDATION OF POLYPEPTIDES AMYLIN PHARMACEUTICALS, INC. (US) 2012-03-22 WO disclosed
US-20090030099-A1 FOAM COMPOSITION AND FOAM THE YOKOHAMA RUBBER CO., LTD. (JP) 2009-01-29 US disclosed
EP-1724318-A1 METHOD FOR ADHESIVE-BONDING VULCANIZED RUBBER COMPOSITIONS BY THE USE OF THERMOPLASTIC ELASTOMER COMPOSITIONS THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-11-22 EP disclosed
US-20060213605-A1 Method for adhesive-bonding vulcanized rubber compositions by the use of thermoplastic elastomer compositions YOKOHAMA RUBBER CO., LTD., THE (JP) 2006-09-28 US disclosed
US-20060199917-A1 thermoplastic elastomer exhibiting high recyclability and oil resistance as well as excellent mechanical strength, and in particular, excellent resistance to compression set is provided. The thermoplastic resin with epoxy, hydroxy or nitrogen groups in backbone YOKOHAMA RUBBER CO., LTD., THE (JP) 2006-09-07 US disclosed
EP-1695987-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-08-30 EP disclosed
US-20060189755-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. 2006-08-24 US disclosed
EP-0218548-B1 CHROMOGENE QUINAZOLINE DERIVATIVES CIBA-GEIGY AG (CH) 1993-08-11 EP disclosed
US-4766211-A FOR PRESSURE SENSITIVE OR HEAT SENSITIVE RECORDING MATERIALS; LIGHTFASTNESS CIBA-GEIGY CORPORATION (US) 1988-08-23 US disclosed
EP-0218548-A2 Chromogene quinazoline derivatives CIBA-GEIGY AG (CH) 1987-04-15 EP 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-20200199081-A1 STK19 INHIBITORS FOR TREATMENT OF CANCER STK11, CDK9, STK3 TDP1 1099/4885ALDH1A1 2015/4885TSHR 3167/4885
US-20230136150-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 TDP1 4502/4885ALDH1A1 3579/4885TSHR 2971/4885
US-20180177767-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS TDP1 3096/4885ALDH1A1 4162/4885TSHR 4359/4885

“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.