SCHEMBL2179006

SCHEMBL2179006

CCOc1ccc(Oc2cccn(Cc3ccc(Cl)cc3Cl)c2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CRHBP P24387 1/20 0.48
CYP2C19 P33261 1/20 0.48
CRHR2 Q13324 1/20 0.48
MAPT P10636 4/20 0.48
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ALDH1A1 P00352 4/20 0.43
PKM P14618 1/20 0.43
RECQL P46063 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DRD4 P21917 1/20 0.40
PTGER3 P43115 1/20 0.40
PTPN1 P18031 1/20 0.40
LMNA P02545 2/20 0.40

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
SCHEMBL22874585 0.69 MAPT (0.65) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL27541379 0.68 DBH (0.51) KDM4ECYP3A4CYP2C9CRHBPCYP2C19
SCHEMBL2175595 0.68 MAPK14 (0.43) SMN1; SMN2ALDH1A1L3MBTL1LMNA
SCHEMBL2174190 0.67 POLB (0.57) KDM4ESMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL2177234 0.66 MAPK14 (0.44) SMN1; SMN2LMNA
SCHEMBL2178094 0.66 EPHX2 (0.47) SMN1; SMN2LMNA
SCHEMBL2175946 0.65 LMNA (0.46) SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL2174653 0.64 LMNA (0.51) KDM4EMAPTTP53SMN1; SMN2MEN1
SCHEMBL2178830 0.64 MAPK14 (0.42) SMN1; SMN2LMNA
SCHEMBL2177202 0.64 MAPK14 (0.53) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948601-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME Crystalgenomics, Inc. (KR) 2008-07-30 EP claimed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US claimed
WO-2007043835-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME CRYSTALGENOMICS, INC. (KR) 2007-04-19 WO claimed
US-7973060-B2 Fab I inhibitor and process for preparing same CRYSTALGENOMICS, INC. (KR) 2011-07-05 US disclosed
EP-1948601-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME Crystalgenomics, Inc. (KR) 2008-07-30 EP disclosed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US disclosed
WO-2007043835-A1 FAB I INHIBITOR AND PROCESS FOR PREPARING SAME CRYSTALGENOMICS, INC. (KR) 2007-04-19 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-20070135465-A1 Fab I Inhibitor and Process for Preparing Same TFPI, TFPI2, FCGRT KDM4E 3785/4885CYP3A4 2161/4885CYP2C9 2630/4885

“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.