SCHEMBL5043830

SCHEMBL5043830

Cc1c(C=O)c(C)n(Cc2cc(-c3sccc3Cl)on2)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 3/20 0.39
VDR P11473 1/20 0.36
ALDH1A1 P00352 7/20 0.32
LMNA P02545 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ERCC5 P28715 1/20 0.32
MEN1 O00255 5/20 0.32
KMT2A Q03164 5/20 0.32
F10 P00742 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HTT P42858 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PPARD Q03181 1/20 0.30
PPARA Q07869 1/20 0.30
MCL1 Q07820 1/20 0.30
CASP3 P42574 2/20 0.30
USP2 O75604 2/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL5038874 0.82 F10 (0.46) F10
SCHEMBL5039054 0.71 F10 (0.44) LMNANPSR1F10HTTMAPT
SCHEMBL5039160 0.67 F10 (0.49) F10
SCHEMBL5035565 0.63 F10 (0.44) F10
SCHEMBL5039077 0.61 F10 (0.48) F10
SCHEMBL6251154 0.60 F10 (0.47) F10
SCHEMBL4607877 0.59 F10 (0.47) F10
SCHEMBL4608313 0.59 F10 (0.47) F10
SCHEMBL4607048 0.59 F10 (0.47) F10
SCHEMBL4606712 0.59 F10 (0.47) F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465806-B2 Pyrrole-derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-12-16 US disclosed
US-20070049573-A1 Pyrrole-Derivatives as Factor Xa Inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-03-01 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-20070049573-A1 Pyrrole-Derivatives as Factor Xa Inhibitors F12, F2, F5 FEN1 642/4885VDR 2045/4885ALDH1A1 2353/4885

“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.