SCHEMBL190809

SCHEMBL190809

O=C(NC(=S)Nc1cc(Oc2c(F)cccc2F)c(Br)cn1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 8/20 0.62
NPC1 O15118 5/20 0.50
KCNH2 Q12809 1/20 0.50
RAB9A P51151 4/20 0.47
PKM P14618 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 3/20 0.45
MET P08581 1/20 0.44
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL190746 0.81 GCK (0.67) GCKNPSR1KMT2AALDH1A1LMNA
SCHEMBL191773 0.80 NPC1 (0.53) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL2659795 0.80 NPC1 (0.51) GCKNPC1KCNH2RAB9APKM
SCHEMBL192186 0.79 NPC1 (0.54) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL190965 0.74 RAB9A (0.45) NPC1KCNH2RAB9APKMEPHX1
SCHEMBL190796 0.71 NPC1 (0.49) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL2783145 0.70 NPC1 (0.68) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL31389479 0.69 EPHX1 (0.59) NPC1RAB9ANPSR1EPHX1KMT2A
SCHEMBL18340834 0.69 NPC1 (0.54) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL3663616 0.68 EPHX1 (0.60) NPC1KCNH2RAB9ANPSR1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986645-B1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2012-01-04 EP disclosed
US-8022222-B2 Glucokinase activators ARRAY BIOPHARMA, INC. (US) 2011-09-20 US disclosed
US-20090247526-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2009-10-01 US disclosed
EP-1986645-A1 GLUCOKINASE ACTIVATORS Array Biopharma, Inc. (US) 2008-11-05 EP disclosed
WO-2007089512-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-08-09 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 (1 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-20090247526-A1 GLUCOKINASE ACTIVATORS GCKR, GCK, GALK1 GCK 2/4885NPC1 1862/4885KCNH2 1689/4885

“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.