SCHEMBL191341

SCHEMBL191341

CCOC(=O)CC(=O)Cc1cc(Nc2nc(CCc3ccccc3)cs2)ncc1Br

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 6/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
GCK P35557 1/20 0.41
MAPT P10636 5/20 0.41
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL191430 0.94 LMNA (0.46) MEN1KMT2AHPGDLMNATP53
SCHEMBL190604 0.86 GAA (0.43) ALDH1A1GCKMAPTGAANPC1
SCHEMBL27741187 0.84 AOC3 (0.41) GCKMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL192244 0.77 GCK (0.44) MEN1KMT2AGCKGAANPC1
SCHEMBL190789 0.76 GCK (0.42) MEN1KMT2AGCKNPC1RAB9A
SCHEMBL191480 0.76 GCK (0.54) GCK
Hydrochloric Acid SCHEMBL191165 0.76 GCK (0.43) MEN1KMT2AGCKGAANPC1
SCHEMBL190933 0.76 GCK (0.41) GCKSMN1; SMN2NPC1RAB9A
SCHEMBL190970 0.75 TRPV4 (0.40) MEN1KMT2ATP53ALDH1A1CYP2C9
SCHEMBL191334 0.75 GCK (0.41) MEN1KMT2AGCKSMN1; SMN2NPC1

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 MEN1 3595/4885KMT2A 2715/4885HPGD 1204/4885

“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.