SCHEMBL10073867

SCHEMBL10073867

COc1ccc2c(C(=O)c3ccc(CO)cc3)n[nH]c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
PRKAG1 P54619 4/20 0.44
PRKAA1 Q13131 4/20 0.44
PRKAB1 Q9Y478 4/20 0.44
PRKAB2 O43741 3/20 0.44
PRKAA2 P54646 3/20 0.44
PRKAG3 Q9UGI9 3/20 0.44
PRKAG2 Q9UGJ0 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
AURKB Q96GD4 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43

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
SCHEMBL10073863 0.85 CYP1A2 (0.50) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL13844083 0.84 DYRK1A (0.43) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL14387458 0.83 TUBB1 (0.46) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL13844093 0.80 PRKAG1 (0.40) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL10073860 0.80 PRKAG1 (0.44) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL14001681 0.79 TUBB1 (0.52) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL13931749 0.79 TUBB1 (0.61) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL13844150 0.79 PRKAG1 (0.42) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL13794487 0.79 L3MBTL1 (0.47) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL13936217 0.78 PRKAG1 (0.39) SMN1; SMN2PRKAG1PRKAA1PRKAB1PRKAB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562909-B1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK SHARP & DOHME (US) 2012-06-27 EP disclosed
US-7547720-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2009-06-16 US disclosed
US-7547720-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2009-06-16 US disclosed
EP-1663987-B1 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO INC (US) 2009-03-18 EP disclosed
US-7410992-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2008-08-12 US disclosed
US-7410992-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2008-08-12 US disclosed
US-20070129418-A1 Ophthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME LLC 2007-06-07 US disclosed
US-20070129418-A1 Ophthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME LLC 2007-06-07 US disclosed
US-7196082-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2007-03-27 US disclosed
US-7196082-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2007-03-27 US disclosed
US-20070010491-A1 Ophthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME LLC 2007-01-11 US disclosed
US-20070010491-A1 Ophthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME LLC 2007-01-11 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 (2 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-20070010491-A1 Ophthalmic compositions for treating ocular hypertension REN, KCNH2, KCNH3 SMN1; SMN2 1354/4885PRKAG1 2052/4885PRKAA1 1487/4885
US-20070129418-A1 Ophthalmic compositions for treating ocular hypertension KCNH2, KCNJ11, KCNN1 SMN1; SMN2 2010/4885PRKAG1 966/4885PRKAA1 2015/4885

“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.