SCHEMBL731203

SCHEMBL731203

COC(=O)c1cc(OCc2ccccc2)cc(-c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
HPGD P15428 1/20 0.62
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
MAOB P27338 2/20 0.52
NR4A2 P43354 3/20 0.52
MRGPRX4 Q96LA9 3/20 0.52
SMPD1 P17405 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
NR1H4 Q96RI1 1/20 0.49
PTPN1 P18031 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
PPARG P37231 1/20 0.48
PPARD Q03181 1/20 0.48
NR4A1 P22736 1/20 0.48
NR4A3 Q92570 1/20 0.48
MAPT P10636 1/20 0.47
GSTP1 P09211 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
SCHEMBL8900334 0.90 SMPD1 (0.60) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL391547 0.90 MEN1 (0.71) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL183994 0.90 LMNA (0.70) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL2260868 0.89 MRGPRX4 (0.60) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL8663810 0.86 LMNA (0.59) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL3629958 0.86 LMNA (0.55) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL29788280 0.86 LMNA (0.65) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL29475634 0.86 LMNA (0.69) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL3129603 0.86 MEN1 (0.74) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL340311 0.86 LMNA (0.65) LMNAHPGDMEN1KMT2AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10174062-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2019-01-08 US disclosed
US-10174062-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2019-01-08 US disclosed
US-10005805-B2 2018-06-26 US disclosed
US-10005805-B2 2018-06-26 US disclosed
US-10005805-B2 2018-06-26 US disclosed
US-20170096440-A1 NOVEL ACTIVATORS OF GLUCOKINASE METABASIS THERAPEUTICS, INC. 2017-04-06 US disclosed
US-20170096440-A1 NOVEL ACTIVATORS OF GLUCOKINASE METABASIS THERAPEUTICS, INC. 2017-04-06 US disclosed
US-20170096440-A1 NOVEL ACTIVATORS OF GLUCOKINASE METABASIS THERAPEUTICS, INC. 2017-04-06 US disclosed
CN-106279283-A Novel activators of glucokinase 症变治疗公司 2017-01-04 CN disclosed
US-9522926-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2016-12-20 US disclosed
US-20090270436-A1 SPIROCHROMANON DERIVATIVES MERCK SHARP & DOHME LLC 2009-10-29 US disclosed
US-20090270436-A1 SPIROCHROMANON DERIVATIVES MERCK SHARP & DOHME LLC 2009-10-29 US disclosed
WO-2009023718-A2 NOVEL ACTIVATORS OF GLUCOKINASE METABASIS THERAPEUTICS, INC. (US) 2009-02-19 WO disclosed
WO-2008088692-A2 SPIROCHROMANON DERIVATIVES MERCK & CO., INC. (US) 2008-07-24 WO disclosed
CN-1080257-C Guanidine derivatives as inhibitors of Na+/H+ exchange in cells FUJISAWA PHARMACEUTICAL CO (JP) 2002-03-06 CN disclosed
EP-0699185-B1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
US-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 US disclosed
CN-1123545-A Guanidine derivatives as inhibitors of Na+/H+ exchange in cells FUJISAWA PHARMACEUTICAL CO (JP) 1996-05-29 CN disclosed
EP-0699185-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-03-06 EP disclosed
WO-1994026709-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+/H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 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 (4 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-10005805-B2 GCKR, GCK, HK1 LMNA 3338/4885HPGD 1767/4885MEN1 2932/4885
US-20090270436-A1 SPIROCHROMANON DERIVATIVES AKR1C3, CBR3, AKR1C4 LMNA 2503/4885HPGD 2417/4885MEN1 2567/4885
US-20170096440-A1 NOVEL ACTIVATORS OF GLUCOKINASE GCKR, GCK, HK1 LMNA 3764/4885HPGD 2115/4885MEN1 3209/4885
US-10174062-B2 Activators of glucokinase GCKR, GCK, HK1 LMNA 3697/4885HPGD 1997/4885MEN1 3043/4885

“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.