SCHEMBL280622

SCHEMBL280622

CCN1C(=O)CCC1CCC=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.34
PTGER3 P43115 4/20 0.34
PTGER2 P43116 4/20 0.34
P2RX7 Q99572 13/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL635958 0.82 PTGER4 (0.40) PTGER4PTGER3PTGER2P2RX7KMT2A
SCHEMBL2034493 0.80 PTGER4 (0.36) PTGER4PTGER3PTGER2P2RX7KMT2A
SCHEMBL1866699 0.79 PTGER4 (0.44) PTGER4PTGER3PTGER2P2RX7KMT2A
SCHEMBL13651410 0.77 PER2 (0.42) P2RX7KMT2A
SCHEMBL2782894 0.77 PER2 (0.42) P2RX7KMT2A
SCHEMBL11364946 0.76 PTGER4 (0.48) PTGER4PTGER3PTGER2KMT2A
SCHEMBL265281 0.75 PTGER3 (0.50) PTGER4PTGER3PTGER2P2RX7KMT2A
SCHEMBL11949258 0.74 L3MBTL1 (0.39) P2RX7KMT2AL3MBTL1
SCHEMBL2037183 0.74 P2RX7 (0.39) P2RX7
SCHEMBL11518007 0.74 KMT2A (0.38) P2RX7KMT2AL3MBTL1

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-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2012-05-31 US disclosed
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-08-06 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 (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-20120136025-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY10, P2RY12, P2RY11 PTGER4 84/4885PTGER3 94/4885PTGER2 169/4885
US-20090197834-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF P2RY12, P2RY11, P2RY10 PTGER4 100/4885PTGER3 79/4885PTGER2 155/4885

“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.