SCHEMBL1866699

SCHEMBL1866699

CCCCC1CCC(=O)N1CC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 6/20 0.44
PTGER2 P43116 5/20 0.44
PTGER3 P43115 4/20 0.44
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 2/20 0.35
P2RX7 Q99572 5/20 0.35
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.33
MDM2 Q00987 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
SCHEMBL11364946 0.93 PTGER4 (0.48) PTGER4PTGER2PTGER3KMT2AMEN1
SCHEMBL635958 0.89 PTGER4 (0.40) PTGER4PTGER2PTGER3KMT2AP2RX7
SCHEMBL1865254 0.87 PTGER4 (0.52) PTGER4PTGER2PTGER3KMT2AMEN1
SCHEMBL2034493 0.83 PTGER4 (0.36) PTGER4PTGER2PTGER3KMT2AP2RX7
SCHEMBL10750938 0.82 PTGER4 (0.57) PTGER4PTGER2PTGER3KMT2AMEN1
SCHEMBL13651410 0.80 PER2 (0.42) KMT2AP2RX7
SCHEMBL2782894 0.80 PER2 (0.42) KMT2AP2RX7
SCHEMBL12298852 0.80 PTGER4 (0.52) PTGER4PTGER2PTGER3KMT2AMEN1
SCHEMBL12993185 0.80 PTGER4 (0.52) PTGER4PTGER2PTGER3KMT2AMEN1
SCHEMBL13205695 0.79 PTGER4 (0.42) PTGER4PTGER2PTGER3KMT2AMEN1

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-20120269750-A1 COSMETIC COMPOSITIONS COMPRISING AN ESTER DERIVED FROM 4-CARBOXY-2-PYRROLIDINONE AND A LIPOPHILIC SCREENING AGENT; USE OF SAID DERIVATIVE AS A SOLVENT FOR A BENZOPHENONE LIPOPHILIC SCREENING AGENT L'OREAL (FR) 2012-10-25 US disclosed
EP-2496207-A1 COSMETIC COMPOSITIONS COMPRISING AN ESTER DERIVED FROM 4-CARBOXY-2-PYRROLIDINONE AND A LIPOPHILIC SCREENING AGENT; USE OF SAID DERIVATIVE AS A SOLVENT FOR A BENZOPHENONE LIPOPHILIC SCREENING AGENT L'Oréal (FR) 2012-09-12 EP disclosed
WO-2011054388-A1 COSMETIC COMPOSITIONS COMPRISING AN ESTER DERIVED FROM 4-CARBOXY-2-PYRROLIDINONE AND A LIPOPHILIC SCREENING AGENT; USE OF SAID DERIVATIVE AS A SOLVENT FOR A BENZOPHENONE LIPOPHILIC SCREENING AGENT L'OREAL (FR) 2011-05-12 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-20120269750-A1 COSMETIC COMPOSITIONS COMPRISING AN ESTER DERIVED FROM 4-CARBOXY-2-PYRROLIDINONE AND A LIPOPHILIC SCREENING AGENT; USE OF SAID DERIVATIVE AS A SOLVENT FOR A BENZOPHENONE LIPOPHILIC SCREENING AGENT C1S, PAH, CYP51A1 PTGER4 193/4885PTGER2 256/4885PTGER3 607/4885

“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.