SCHEMBL1287488

SCHEMBL1287488

CCc1cc2ccc(OC)cc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
HPGD P15428 4/20 0.54
CA12 O43570 3/20 0.54
CA9 Q16790 3/20 0.54
KDM4E B2RXH2 3/20 0.54
CA3 P07451 2/20 0.54
CA4 P22748 2/20 0.54
CA6 P23280 2/20 0.54
CA7 P43166 2/20 0.54
CA14 Q9ULX7 2/20 0.54
CA1 P00915 2/20 0.54
HSD17B10 Q99714 2/20 0.54
AKR1B1 P15121 1/20 0.54
CA5A P35218 1/20 0.54
CA2 P00918 3/20 0.51
GLA P06280 3/20 0.50
GAA P10253 3/20 0.50
MAOB P27338 2/20 0.50
CYP2C19 P33261 1/20 0.50
SLC16A3 O15427 1/20 0.49

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
SCHEMBL1287525 0.86 CYP2A6 (0.53) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL7289069 0.84 ALDH1A1 (0.53) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL11714226 0.84 ALDH1A1 (0.53) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31173762 0.81 MTNR1A (0.52) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31173753 0.80 MTNR1A (0.51) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL1287540 0.80 ALDH1A1 (0.53) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31064189 0.79 SLC16A3 (0.57) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31173760 0.79 CYP2D6 (0.55) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31683164 0.79 GPR55 (0.71) ALDH1A1HPGDCA12CA9KDM4E
SCHEMBL31173754 0.79 HTR2A (0.53) ALDH1A1HPGDCA12CA9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005750-B2 Developing potent urate transporter inhibitors: compounds designed for their uricosuric action J-PHARMA CO., LTD. (JP) 2018-06-26 US disclosed
US-20130225673-A1 DEVELOPING POTENT URATE TRANSPORTER INHIBITORS: COMPOUNDS DESIGNED FOR THEIR URICOSURIC ACTION J-PHARMA CO., LTD. (JP) 2013-08-29 US disclosed
WO-2012048058-A2 DEVELOPING POTENT URATE TRANSPORTER INHIBITORS: COMPOUNDS DESIGNED FOR THEIR URICOSURIC ACTION J-PHARMA CO., LTD. (JP) 2012-04-12 WO disclosed
US-7521570-B2 Medicinal compositions containing 6-hydroxybenzbromarone or salts thereof TORLI PHARMACEUTICAL CO., LTD. (JP) 2009-04-21 US disclosed
EP-1515975-B1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER (US) 2007-09-19 EP disclosed
EP-1515975-B1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER (US) 2007-09-19 EP disclosed
US-20070185195-A1 Medicinal compositions containing 6-hydroxybenzbromarone or salts thereof HUMAN CELL SYSTEMS, INC. (JP) 2007-08-09 US disclosed
EP-1767531-A1 MEDICINAL COMPOSITIONS CONTAINING 6-HYDROXYBENZBROMARONE OR SALTS THEREOF Torii Pharmaceutical Co., Ltd. (JP) 2007-03-28 EP disclosed
US-7045528-B2 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
US-20060079548-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use AGOURON PHARMACEUTICALS, INC. 2006-04-13 US disclosed
EP-1515975-A1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER INC. (US) 2005-03-23 EP disclosed
US-6869962-B2 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-03-22 US disclosed
US-20040186126-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use AGOURON PHARMACEUTICALS, INC. 2004-09-23 US disclosed
US-20040009965-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use AGOURON PHARMACEUTICALS, INC. 2004-01-15 US disclosed
WO-2003106462-A1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER INC. (US) 2003-12-24 WO 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-10005750-B2 Developing potent urate transporter inhibitors: compounds designed for their uricosuric action SLCO2B1, SLCO2A1, SLC10A6 ALDH1A1 1289/4885HPGD 1132/4885CA12 634/4885
US-20040186126-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use DPYD, DHFR, TYMP ALDH1A1 836/4885HPGD 34/4885CA12 4792/4885
US-20040009965-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use DPYD, DHFR, TYMP ALDH1A1 836/4885HPGD 34/4885CA12 4792/4885
US-20130225673-A1 DEVELOPING POTENT URATE TRANSPORTER INHIBITORS: COMPOUNDS DESIGNED FOR THEIR URICOSURIC ACTION SLCO2B1, SLCO2A1, SLC10A6 ALDH1A1 1289/4885HPGD 1132/4885CA12 634/4885
US-20060079548-A1 Benzofused heterozryl amide derivatives of thienopyridines useful as therapeutic agents, pharmaceutical compositions including the same, and methods for their use TPD52L2, DPYD, CCND2 ALDH1A1 1017/4885HPGD 110/4885CA12 4787/4885
US-20070185195-A1 Medicinal compositions containing 6-hydroxybenzbromarone or salts thereof XDH, UGT1A6, SLC10A1 ALDH1A1 226/4885HPGD 170/4885CA12 3296/4885

“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.