SCHEMBL2148964

SCHEMBL2148964

O=C(Nc1cccc2c(=O)cc(-c3ccccc3C(F)(F)F)oc12)c1cscn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 6/20 0.46
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ TSHR P16473 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ P2RY1 P47900 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ GRM1 Q13255 1/20 0.41
▸ MAPT P10636 4/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ XBP1 P17861 1/20 0.41
▸ PIM1 P11309 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CLK1 P49759 1/20 0.39
▸ CYSLTR2 Q9NS75 2/20 0.38
▸ CYSLTR1 Q9Y271 2/20 0.38

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
SCHEMBL12220134 0.90 GPR35 (0.43) GPR35NPC1RAB9AKMT2ATSHR
SCHEMBL12220045 0.89 GPR35 (0.46) GPR35NPC1RAB9AKMT2ATSHR
SCHEMBL12220116 0.88 GPR35 (0.48) GPR35NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL12220171 0.88 GPR35 (0.44) GPR35NPC1KMT2AGRM1NPSR1
SCHEMBL12220125 0.87 MAPT (0.52) GPR35NPC1RAB9AKMT2ARECQL
SCHEMBL12220021 0.86 GPR35 (0.48) GPR35NPC1RAB9AKMT2ARECQL
SCHEMBL12220086 0.86 GPR35 (0.48) GPR35NPC1RAB9AALDH1A1GRM1
SCHEMBL12220067 0.85 SMN1; SMN2 (0.50) GPR35NPC1RAB9AKMT2ATSHR
SCHEMBL12220128 0.85 GPR35 (0.46) GPR35KMT2AP2RY1RECQLGRM1
SCHEMBL12220119 0.85 GPR35 (0.45) GPR35KMT2AGRM1MEN1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150148343-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS GlaxoSmithKline, LLC 2015-05-28 — — US disclosed
US-20150148343-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS GlaxoSmithKline, LLC 2015-05-28 — — US disclosed
US-20150148343-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS GlaxoSmithKline, LLC 2015-05-28 — — US disclosed
US-8987258-B2 Chromenone analogs as sirtuin modulators GLAXOSMITHKLINE LLC 2015-03-24 — — US disclosed
US-8987258-B2 Chromenone analogs as sirtuin modulators GLAXOSMITHKLINE LLC 2015-03-24 — — US disclosed
US-8987258-B2 Chromenone analogs as sirtuin modulators GLAXOSMITHKLINE LLC 2015-03-24 — — US disclosed
EP-2342188-B1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2014-07-30 — — EP disclosed
EP-2342188-B1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2014-07-30 — — EP disclosed
US-20110257174-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2011-10-20 — — US disclosed
US-20110257174-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2011-10-20 — — US disclosed
US-20110257174-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2011-10-20 — — US disclosed
EP-2342188-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS Sirtris Pharmaceuticals, Inc. (US) 2011-07-13 — — EP disclosed
WO-2010037127-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2010-04-01 — — WO disclosed
WO-2010037127-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2010-04-01 — — 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 (2 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-20110257174-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 GPR35 866/4885NPC1 3233/4885RAB9A 1678/4885
US-20150148343-A1 CHROMENONE ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 GPR35 627/4885NPC1 2949/4885RAB9A 1956/4885

“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