SCHEMBL15364115

SCHEMBL15364115

Nc1cccc2c1C1=CC=C2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.45
ADORA2A P29274 3/20 0.41
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FGR P09769 1/20 0.35
PIM1 P11309 1/20 0.35
MAOA P21397 1/20 0.35
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
DYRK1A Q13627 1/20 0.35
HIPK2 Q9H2X6 1/20 0.35
CSNK1G1 Q9HCP0 1/20 0.35
HSPA1A P0DMV8 1/20 0.35
PABPC1 P11940 1/20 0.35
CYP3A4 P08684 3/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 2/20 0.33
HPGD P15428 2/20 0.33
DPP4 P27487 1/20 0.33
PDK2 Q15119 1/20 0.33

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
SCHEMBL15364118 1.00 PTPRC (0.45) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL7392371 0.70 MAOA (0.38) PTPRCALDH1A1L3MBTL1MAOACYP3A4
SCHEMBL4552082 0.70 MAOA (0.38) PTPRCALDH1A1L3MBTL1MAOACYP3A4
SCHEMBL1578324 0.69 PTPRC (0.67) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL28547340 0.69 PTPRC (0.67) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL5493737 0.67 ALDH1A1 (0.68) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL3036922 0.66 CYP3A4 (0.57) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL7389021 0.66 ALDH1A1 (0.67) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL2048985 0.65 ALDH1A1 (0.48) PTPRCADORA2AALDH1A1L3MBTL1FGR
SCHEMBL29490146 0.65 ALDH1A1 (0.48) PTPRCADORA2AALDH1A1L3MBTL1FGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9375004-B2 5-halogenopyrazolecarboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-20130296269-A1 5-Halogenopyrazolecarboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-07 US 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-20130296269-A1 5-Halogenopyrazolecarboxamides CYP3A5, CBR3, HDHD5 PTPRC 1185/4885ADORA2A 4655/4885ALDH1A1 3455/4885

“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.