SCHEMBL8306645

SCHEMBL8306645

Cc1ccc(-n2ccoc2=O)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.40
GRM4 Q14833 3/20 0.36
GRM1 Q13255 2/20 0.36
HSD17B10 Q99714 1/20 0.34
AGTR1 P30556 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
NPBWR1 P48145 2/20 0.33
MCHR1 Q99705 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ACHE P22303 1/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 1/20 0.32
BCHE P06276 1/20 0.32
RAB9A P51151 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL8306976 0.83 NPSR1 (0.46) GRM1HSD17B10NPSR1L3MBTL1ALDH1A1
SCHEMBL8306571 0.81 MAP3K5 (0.39) GRM4GRM1HSD17B10NPSR1ALDH1A1
SCHEMBL8306979 0.72 METAP2 (0.48) METAP2GRM4HSD17B10AGTR1NPSR1
SCHEMBL8303637 0.72 ELANE (0.43) HSD17B10ALDH1A1HPGDRAB9A
SCHEMBL8306574 0.71 ALDH1A1 (0.46) METAP2GRM4AGTR1NPSR1L3MBTL1
SCHEMBL8306420 0.69 MAPK14 (0.43) METAP2GRM4GRM1AGTR1NPBWR1
SCHEMBL23388366 0.67 MGLL (0.55) METAP2AGTR1NPSR1ALDH1A1ACHE
SCHEMBL29485051 0.67 MGLL (0.55) METAP2AGTR1NPSR1ALDH1A1ACHE
SCHEMBL11614476 0.67 MEN1 (0.50) METAP2GRM4GRM1AGTR1L3MBTL1
SCHEMBL31116725 0.67 ROCK1 (0.47) METAP2ALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS QIAO JENNIFER X 2007-06-14 US disclosed
US-7205318-B2 Lactam-containing cyclic diamines and derivatives as a factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 US disclosed
WO-2004082687-A1 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-09-30 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-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS F12, F2, PEPD METAP2 128/4885GRM4 2186/4885GRM1 1488/4885

“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.