SCHEMBL12021499

SCHEMBL12021499

CC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2nc3ccc(P(=O)(O)O)cc3s2)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 12/20 0.62
▸ KDM4E B2RXH2 4/20 0.61
▸ MEN1 O00255 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ NPC1 O15118 3/20 0.61
▸ RAB9A P51151 3/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ MAPT P10636 2/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ RXFP1 Q9HBX9 2/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ LMNA P02545 1/20 0.55

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
SCHEMBL18707629 0.93 GCK (0.62) GCKKDM4EMEN1KMT2ANPC1
SCHEMBL12021278 0.87 GCK (0.62) GCKKDM4EMEN1KMT2ANPC1
SCHEMBL12021228 0.85 GCK (0.61) GCK
SCHEMBL12021320 0.84 NPC1 (0.53) GCKKDM4EMEN1KMT2ANPC1
SCHEMBL12021329 0.82 GCK (0.62) GCK
SCHEMBL2669971 0.81 GCK (0.71) GCKKDM4ERAB9A
SCHEMBL12021674 0.81 GCK (0.67) GCK
SCHEMBL3605942 0.80 GCK (0.70) GCK
SCHEMBL12021481 0.79 GCK (0.55) GCKNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL12021628 0.78 GCK (0.66) GCK

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
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-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-9522926-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2016-12-20 — — US disclosed
US-9522926-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2016-12-20 — — US disclosed
US-20150119365-A1 NOVEL ACTIVATORS OF GLUCOKINASE CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-04-30 — — US disclosed
US-20150119365-A1 NOVEL ACTIVATORS OF GLUCOKINASE CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2015-04-30 — — US disclosed
US-8940927-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2015-01-27 — — US disclosed
US-8940927-B2 Activators of glucokinase METABASIS THERAPEUTICS, INC. (US) 2015-01-27 — — US disclosed
US-20110294758-A1 NOVEL ACTIVATORS OF GLUCOKINASE METABASIS THERAPEUTICS, INC. (US) 2011-12-01 — — 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 (5 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 GCK 2/4885KDM4E 4072/4885MEN1 2932/4885
US-20150119365-A1 NOVEL ACTIVATORS OF GLUCOKINASE GCKR, GCK, HK1 GCK 2/4885KDM4E 3996/4885MEN1 3209/4885
US-20110294758-A1 NOVEL ACTIVATORS OF GLUCOKINASE GCKR, GCK, HK1 GCK 2/4885KDM4E 3996/4885MEN1 3209/4885
US-20170096440-A1 NOVEL ACTIVATORS OF GLUCOKINASE GCKR, GCK, HK1 GCK 2/4885KDM4E 3996/4885MEN1 3209/4885
US-10174062-B2 Activators of glucokinase GCKR, GCK, HK1 GCK 2/4885KDM4E 4021/4885MEN1 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.

Send feedback