SCHEMBL6787130

SCHEMBL6787130

CCC1CCC(=O)N1c1ccc(C(C)C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 12/20 0.47
PTGER4 P35408 1/20 0.47
PTGDR Q13258 5/20 0.46
PTGS1 P23219 5/20 0.45
PTGS2 P35354 5/20 0.45
HTT P42858 2/20 0.45
KMT2A Q03164 2/20 0.45
OPRK1 P41145 1/20 0.45
PTGER3 P43115 6/20 0.45
PTGER1 P34995 1/20 0.44
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.41
PGR P06401 1/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6789385 0.90 PTGER2 (0.46) PTGER2PTGER4PTGDRPTGS1PTGS2
SCHEMBL6788699 0.82 CCNA2 (0.55) PTGER2PTGS1PTGS2HTTKMT2A
SCHEMBL6789700 0.79 PHGDH (0.42) PTGER2PTGS1PTGS2HTTKMT2A
SCHEMBL6789962 0.78 PTGER2 (0.49) PTGER2PTGER4PTGDRPTGER3PTGER1
SCHEMBL9892975 0.78 PTGER2 (0.44) PTGER2PTGER4PTGDRKMT2APTGER3
SCHEMBL6783997 0.78 CCNA2 (0.60) PTGER4PTGS1PTGS2HTTKMT2A
SCHEMBL9893157 0.76 PTGER2 (0.42) PTGER2PTGER4PTGDRPTGER3PTGER1
SCHEMBL9893023 0.76 PER2 (0.46) PTGER2PTGDRKMT2APTGER3MEN1
SCHEMBL9892983 0.75 PTGER2 (0.46) PTGER2PTGER4PTGDRHTTKMT2A
SCHEMBL6787303 0.74 CCNA2 (0.78)

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-20040019046-A1 Phenylacetamido-pyrazole derivatives and their use as antitumor agents PHARMACIA ITALIA SPA (IT) 2004-01-29 US disclosed
EP-1345909-A1 PHENYLACETAMIDO-PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2003-09-24 EP disclosed
WO-2002048114-A1 PHENYLACETAMIDO- PYRAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2002-06-20 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-20040019046-A1 Phenylacetamido-pyrazole derivatives and their use as antitumor agents DCK, CCNK, CDK2 PTGER2 4073/4885PTGER4 3389/4885PTGDR 2331/4885

“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.