SCHEMBL4086022

SCHEMBL4086022

Cc1ccc(-c2sc3cc(C(=O)O)n(Cc4cccc(Cl)c4)c3c2C)s1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.50
CCR9 P51686 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
PDE1B Q01064 1/20 0.39
PTGER4 P35408 1/20 0.38
PTGDR Q13258 1/20 0.38

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
SCHEMBL4097358 0.82 CCR2 (0.44) CCR2CCR9MAPTPTGER4PTGDR
SCHEMBL4092463 0.82 CCR2 (0.55) CCR2CCR9MAPT
SCHEMBL4093394 0.78 CCR2 (0.55) CCR2CCR9PTGDR2KDM4EPDE1B
SCHEMBL4086016 0.77 CCR2 (0.49) CCR2CCR9MAPTPTGER4PTGDR
SCHEMBL4086613 0.71 MAPT (0.50) MAPTKDM4EPOLB
SCHEMBL4086498 0.70 TP53 (0.46) CCR2CCR9MAPTPOLB
SCHEMBL4104997 0.70 CCR2 (0.53) CCR2CCR9MAPT
SCHEMBL4096957 0.69 PTGES (0.52) CCR2PTGDR2MAPTKDM4EPOLB
SCHEMBL4097166 0.68 CCR9 (0.45) CCR2CCR9MAPT
SCHEMBL18890618 0.68 TP53 (0.58) MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2009-03-12 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 (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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION NPY5R, TH, PTGES CCR2 1118/4885CCR9 2391/4885PTGDR2 60/4885

“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.