SCHEMBL989429

SCHEMBL989429

COC(=O)c1cccc2ccn(Cc3ccc(-c4ccccn4)cc3)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.43
AXL P30530 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40
ADAM17 P78536 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA3 P34903 1/20 0.40
PTGER4 P35408 1/20 0.39
PTGDR Q13258 1/20 0.39
MCHR1 Q99705 1/20 0.39
ALDH1A1 P00352 1/20 0.39
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL12584205 0.87 HCAR2 (0.48) HCAR2PTGER4PTGDRAGTR1AGTR2
SCHEMBL987514 0.86 PTGER4 (0.46) MMP9PTGER4PTGDRSLC6A2SLC6A4
SCHEMBL22276248 0.85 CYP11B1 (0.41) PTGER4PTGDRALDH1A1
SCHEMBL12584155 0.85 PKN1 (0.44) PTGER4PTGDRALDH1A1HDAC6
SCHEMBL12584207 0.84 PTGER4 (0.58) PTGER4PTGDR
SCHEMBL10019032 0.83 PTGER4 (0.49) PTGER4PTGDRALDH1A1
SCHEMBL12584303 0.82 AGTR2 (0.41) PTGER4PTGDRAGTR2
SCHEMBL986585 0.81 NR4A2 (0.45) GABRG2GABRB3GABRA3
SCHEMBL1271452 0.81 PTGER4 (0.48) PTGER4PTGDRALDH1A1SLC6A4SLC6A3
SCHEMBL12584265 0.80 ALOX15 (0.42) PTGER4PTGDRMCHR1ALDH1A1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598355-B2 Amide compound ASTELLAS PHARMA INC. (JP) 2013-12-03 US disclosed
EP-2565191-A1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy Astellas Pharma Inc. (JP) 2013-03-06 EP disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
WO-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 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-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 GRM5 395/4885AXL 2656/4885HCAR2 69/4885

“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.