SCHEMBL6795586

SCHEMBL6795586

Cc1csc(Nc2cccc(N)c2)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.68
KMT2A Q03164 8/20 0.68
RAB9A P51151 7/20 0.68
NPC1 O15118 5/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
MAPK1 P28482 3/20 0.58
MAPT P10636 7/20 0.55
MEN1 O00255 7/20 0.55
ALDH1A1 P00352 2/20 0.55
CCR4 P51679 2/20 0.52
KDM4E B2RXH2 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
CSNK2A1 P68400 1/20 0.50
PLK3 Q9H4B4 1/20 0.50
HTT P42858 1/20 0.50
RAPGEF4 Q8WZA2 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
LMNA P02545 2/20 0.49
GFER P55789 1/20 0.49
USP2 O75604 1/20 0.47

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
SCHEMBL3049195 0.83 KMT2A (0.66) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL4548018 0.81 GAA (1.00) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6799628 0.81 RAB9A (0.55) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL4560986 0.80 GAA (0.77) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6798095 0.79 ALOX5 (0.71) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL14433270 0.77 GAA (0.68) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL11325137 0.77 GAA (0.57) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL5554730 0.76 ALDH1A1 (0.52) GAAKMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL13316453 0.74 CCR4 (0.51) GAAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL15177819 0.74 RAB9A (0.68) GAAKMT2ARAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2736904-B1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB SCIENCE (FR) 2016-03-16 EP disclosed
US-9168245-B2 Selective protein kinase inhibitors AB SCIENCE (FR) 2015-10-27 US disclosed
US-20140179698-A1 SELECTIVE PROTEIN KINASE INHIBITORS AB SCIENCE (FR) 2014-06-26 US disclosed
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP disclosed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 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-20140179698-A1 SELECTIVE PROTEIN KINASE INHIBITORS KIT, MAP3K1, PRKCH GAA 1334/4885KMT2A 735/4885RAB9A 876/4885
US-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 GAA 3522/4885KMT2A 968/4885RAB9A 1092/4885

“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.