SCHEMBL6780280

SCHEMBL6780280

COc1ccccc1N1CCN(C(=O)CNC(=O)C(Nc2cccc(C(=N)N)c2)c2ccc(OCC(=O)O)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 3/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.45
POLB P06746 4/20 0.43
KDM4E B2RXH2 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 3/20 0.42
F10 P00742 2/20 0.42
F2 P00734 2/20 0.42
PRSS1 P07477 1/20 0.42
F7 P08709 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.41
RAB9A P51151 1/20 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
SCHEMBL6779135 0.94 TSHR (0.44) LMNAMAPK1KMT2AGAAPKM
SCHEMBL6780268 0.93 F10 (0.46) LMNAKMT2AGAATSHRPOLB
SCHEMBL6779185 0.91 MEN1 (0.47) LMNAKMT2ATSHRPOLBKDM4E
SCHEMBL6779801 0.91 F10 (0.43) LMNAKMT2AGAAPKMTSHR
SCHEMBL6779349 0.90 TSHR (0.48) LMNAMAPK1KMT2AGAAPKM
SCHEMBL6774764 0.89 F2 (0.55) LMNAKMT2AGAATSHRPOLB
SCHEMBL6778302 0.88 POLB (0.45) KMT2APOLBKDM4EMAPTF10
SCHEMBL6777481 0.88 ITGB3 (0.41) LMNAMAPK1KMT2APKMPOLB
SCHEMBL6778829 0.85 ADRA1D (0.43) LMNAMAPK1KMT2AGAAPKM
SCHEMBL6777979 0.84 KDM4E (0.44) KMT2AGAATSHRPOLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794507-B2 Compounds that inhibit factor Xa activity MORPHOCHEM AG (DE) 2004-09-21 US disclosed
US-20030153510-A1 Novel compounds inhibiting factor xa activity CAPPI MICHAEL W (DE) 2003-08-14 US disclosed
EP-1311473-A2 NOVEL COMPOUNDS INHIBITING FACTOR XA ACTIVITY Morphochem AG (DE) 2003-05-21 EP disclosed
WO-2002016312-A2 NOVEL COMPOUNDS INHIBITING FACTOR XA ACTIVITY MORPHOCHEM AG (DE) 2002-02-28 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-20030153510-A1 Novel compounds inhibiting factor xa activity SERPINC1, F11, TFPI LMNA 1168/4885MAPK1 874/4885KMT2A 4159/4885

“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.