SCHEMBL4093522

SCHEMBL4093522

O=C(O)c1cc2sc(-c3ccccc3)cc2n1Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 12/20 0.53
ABCB11 O95342 1/20 0.47
GPR35 Q9HC97 2/20 0.47
CCR9 P51686 1/20 0.46
SERPINE1 P05121 1/20 0.46
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL4086171 0.85 MAPT (0.61) MAPTTHRB
SCHEMBL4097166 0.82 CCR9 (0.45) CCR2ABCB11GPR35CCR9MAPT
SCHEMBL4093410 0.81 TP53 (0.44) CCR2MAPTTHRB
SCHEMBL7682483 0.81 CCR2 (0.58) CCR2ABCB11
SCHEMBL4086498 0.77 TP53 (0.46) CCR2ABCB11GPR35CCR9SERPINE1
SCHEMBL4097147 0.76 CCR2 (0.52) CCR2ABCB11CCR9
SCHEMBL7683277 0.75 ABCB11 (0.65) CCR2ABCB11
SCHEMBL4097557 0.74 CCR2 (0.47) CCR2ABCB11GPR35CCR9MAPT
SCHEMBL4092463 0.74 CCR2 (0.55) CCR2ABCB11CCR9MAPTTHRB
SCHEMBL26784836 0.73 CCR2 (0.46) CCR2ABCB11GPR35CCR9SERPINE1

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 1118/4885ABCB11 4077/4885GPR35 1507/4885

“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.