SCHEMBL11273803

SCHEMBL11273803

CCOC(=O)c1ccc(C)c2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.63
▸ HSD17B10 Q99714 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ CDC25B P30305 5/20 0.54
▸ KDM4E B2RXH2 3/20 0.51
▸ MAOB P27338 1/20 0.51
▸ CNR1 P21554 2/20 0.50
▸ CDC25A P30304 1/20 0.50
▸ CDC25C P30307 1/20 0.50
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ CA14 Q9ULX7 1/20 0.49
▸ CNR2 P34972 2/20 0.47
▸ CLEC4M Q9H2X3 1/20 0.47

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
SCHEMBL29671336 0.93 TSHR (0.73) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL2569253 0.93 TSHR (0.73) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL28416763 0.86 TSHR (0.63) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL9150759 0.85 TSHR (0.73) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL23484418 0.84 TSHR (0.61) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL27560307 0.83 TSHR (0.59) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL5946756 0.83 ALDH1A1 (0.65) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL11749538 0.83 TSHR (0.59) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL4877934 0.83 TSHR (0.59) TSHRHSD17B10ALDH1A1CDC25BKDM4E
SCHEMBL870574 0.81 BRD4 (0.51) TSHRHSD17B10ALDH1A1KDM4E

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107567442-B Inhibitors of hepatitis C virus polymerase 共晶制药公司 2021-05-25 — — CN disclosed
US-10947210-B2 Inhibitors of Hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2021-03-16 — — US disclosed
US-10947210-B2 Inhibitors of Hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2021-03-16 — — US disclosed
US-20200255393-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2020-08-13 — — US disclosed
US-20200255393-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2020-08-13 — — US disclosed
US-10464914-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2019-11-05 — — US disclosed
US-10464914-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2019-11-05 — — US disclosed
EP-3274340-B1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA INC (US) 2019-07-17 — — EP disclosed
US-20180050998-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2018-02-22 — — US disclosed
US-20180050998-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2018-02-22 — — US disclosed
US-20170240521-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-24 — — US disclosed
US-9656981-B2 Peripherally-acting cannabinoid receptor agonists for chronic pain THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-05-23 — — US disclosed
WO-2016154241-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. (US) 2016-09-29 — — WO disclosed
US-20150239859-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-08-27 — — US disclosed
WO-2014015298-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-01-23 — — WO disclosed
US-4315088-A COORDINATION CATALYST MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1982-02-09 — — 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 (6 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-20150239859-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN CNR2, CNR1, OPRL1 TSHR 1275/4885HSD17B10 3930/4885ALDH1A1 3666/4885
US-20200255393-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLI, POLR2E, POLR2H TSHR 4606/4885HSD17B10 919/4885ALDH1A1 114/4885
US-10464914-B2 Inhibitors of hepatitis C virus polymerase POLI, POLR2E, POLR2H TSHR 4606/4885HSD17B10 919/4885ALDH1A1 114/4885
US-20170240521-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN CNR2, CNR1, OPRL1 TSHR 1275/4885HSD17B10 3930/4885ALDH1A1 3666/4885
US-10947210-B2 Inhibitors of Hepatitis C virus polymerase POLI, POLR2E, POLR2H TSHR 4606/4885HSD17B10 919/4885ALDH1A1 114/4885
US-20180050998-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLI, POLR2E, POLR2H TSHR 4606/4885HSD17B10 919/4885ALDH1A1 114/4885

“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.

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