SCHEMBL192186

SCHEMBL192186

O=C(NC(=S)Nc1ncc(Br)c(Oc2c(F)cccc2F)c1Cl)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.54
KCNH2 Q12809 1/20 0.54
NPSR1 Q6W5P4 3/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP2C9 P11712 1/20 0.43
ALOX12 P18054 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EPHX1 P07099 6/20 0.42
RAB9A P51151 3/20 0.42
PKM P14618 1/20 0.41

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
SCHEMBL2464608 0.82 GCK (0.41) ALDH1A1
SCHEMBL190809 0.79 GCK (0.62) NPC1KCNH2NPSR1ALDH1A1SMN1; SMN2
SCHEMBL2522214 0.71 NPC1 (1.00) NPC1KCNH2NPSR1ALDH1A1CYP2C9
SCHEMBL17582498 0.71 PLK1 (0.56) NPC1NPSR1ALDH1A1EPHX1RAB9A
SCHEMBL24092869 0.69 EPHX1 (0.60) NPC1KCNH2NPSR1ALDH1A1EPHX1
SCHEMBL31408209 0.69 EPHX1 (0.60) NPC1KCNH2NPSR1ALDH1A1EPHX1
SCHEMBL20489503 0.69 NPC1 (0.77) NPC1KCNH2NPSR1ALDH1A1SMN1; SMN2
SCHEMBL31167689 0.69 NPC1 (0.72) NPC1KCNH2NPSR1ALDH1A1SMN1; SMN2
SCHEMBL558304 0.69 NPC1 (0.62) NPC1KCNH2NPSR1ALDH1A1SMN1; SMN2
SCHEMBL1330239 0.69 NPC1 (0.64) NPC1KCNH2NPSR1ALDH1A1CYP2C9

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 3 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

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 NPC1 1862/4885KCNH2 1689/4885NPSR1 4344/4885

“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.