SCHEMBL191773

SCHEMBL191773

O=C(NC(=S)Nc1cc(OCc2ccccc2)c(Br)cn1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.53
KCNH2 Q12809 1/20 0.53
RAB9A P51151 6/20 0.50
PKM P14618 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
EPHX1 P07099 4/20 0.47
POLB P06746 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PLK1 P53350 1/20 0.45
MET P08581 1/20 0.44
MITF O75030 1/20 0.44
CYP1A2 P05177 1/20 0.44

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
SCHEMBL190760 0.83 ALDH1A1 (0.43) RAB9AALDH1A1MAPTTDP1KDM4E
SCHEMBL2340858 0.80 NPC1 (0.68) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL190809 0.80 GCK (0.62) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL2659795 0.79 NPC1 (0.51) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL3663990 0.77 TDP1 (0.57) NPC1KCNH2RAB9ANPSR1KMT2A
SCHEMBL190796 0.77 NPC1 (0.49) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL2338840 0.75 PPIA (0.61) NPC1RAB9APKMNPSR1
SCHEMBL190965 0.75 RAB9A (0.45) NPC1KCNH2RAB9APKMKMT2A
SCHEMBL2341873 0.74 NPC1 (0.56) NPC1KCNH2RAB9APKMNPSR1
SCHEMBL191169 0.74 MET (0.47) NPC1KCNH2RAB9APKMNPSR1

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 NPC1 1862/4885KCNH2 1689/4885RAB9A 1808/4885

“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.