SCHEMBL2419902

SCHEMBL2419902

CCn1c(-c2cccc(F)c2)cc2cc(N)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.48
GRIK2 Q13002 1/20 0.48
TAAR1 Q96RJ0 3/20 0.44
KDM4E B2RXH2 6/20 0.41
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 1/20 0.41
HBB P68871 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RAD52 P43351 1/20 0.40
GAA P10253 1/20 0.39
GFER P55789 1/20 0.39
TLR8 Q9NR97 1/20 0.38
ACLY P53396 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL2419891 0.85 GRIK1 (0.48) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL2421447 0.84 GRIK1 (0.65) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL17199126 0.84 GRIK1 (0.48) GRIK1GRIK2TAAR1KDM4EMAPT
SCHEMBL17199125 0.83 GRIK1 (0.45) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL22004132 0.82 ACLY (0.53) GRIK1GRIK2ACLYCYP11B1CYP11B2
SCHEMBL2425532 0.79 CYP19A1 (0.52) GRIK1GRIK2MAPTMEN1KMT2A
SCHEMBL22694522 0.77 GRIK1 (0.49) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL2422990 0.77 KDM4E (0.46) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL17199140 0.76 GRIK1 (0.48) GRIK1GRIK2KDM4EMAPTALDH1A1
SCHEMBL17199129 0.76 GRIK1 (0.45) GRIK1GRIK2KDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049480-B1 2-ARYLINDOLE DERIVATIVES AS mPGES-1 INHIBITORS ACRAF (IT) 2013-10-30 EP disclosed
CN-101490000-B 2-Arylindole derivatives as mPGEs-1 inhibitors ACRAF 2012-10-03 CN disclosed
US-8017644-B2 2-arylindole derivatives as nPGES-1 inhibitors AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2011-09-13 US disclosed
US-20090186922-A1 2-ARYLINDOLE DERIVATIVES AS NPGES-I INHIBITORS AZIENDE CHIM. RIUN. ANG. FRANC. A.C.R.A.F. S.P.A. (IT) 2009-07-23 US disclosed
CN-101490000-A 2-arylindole derivatives as NPGES-1 inhibitors ACRAF (IT) 2009-07-22 CN disclosed
EP-2049480-A1 2-ARYLINDOLE DERIVATIVES AS NPGES-I INHIBITORS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.p.A. (IT) 2009-04-22 EP disclosed
WO-2008006663-A1 2-ARYLINDOLE DERIVATIVES AS NPGES-I INHIBITORS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2008-01-17 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-20090186922-A1 2-ARYLINDOLE DERIVATIVES AS NPGES-I INHIBITORS PTGES, NAT1, CSNK1G2 GRIK1 1260/4885GRIK2 773/4885TAAR1 810/4885

“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.