SCHEMBL6774635

SCHEMBL6774635

N=C(N)c1cccc(NC(C(=O)NCC(=O)N2CCN(c3ccccc3O)CC2)c2ccccc2OCC(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 4/20 0.42
POLB P06746 2/20 0.42
EIF4H Q15056 1/20 0.41
GFER P55789 2/20 0.39
F10 P00742 5/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PRSS1 P07477 4/20 0.37
TSHR P16473 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
F2 P00734 1/20 0.36
TPSAB1 Q15661 1/20 0.36
TPSD1 Q9BZJ3 1/20 0.36
TPSG1 Q9NRR2 1/20 0.36

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
SCHEMBL6779349 0.92 TSHR (0.48) RAB9AKMT2AGAAPOLBLMNA
SCHEMBL6777979 0.86 KDM4E (0.44) RAB9AKMT2AGAAPOLBMAPT
SCHEMBL6777370 0.86 F7 (0.50) RAB9AKMT2AGAAPOLBEIF4H
SCHEMBL6779912 0.85 ITGB3 (0.41) F10LMNAMAPTALDH1A1PRSS1
SCHEMBL6780280 0.82 LMNA (0.47) RAB9AKMT2AGAAPOLBF10
SCHEMBL6779135 0.81 TSHR (0.44) KMT2AGAAPOLBF10LMNA
SCHEMBL6784534 0.81 GCGR (0.40) KMT2AF10PRSS1F2TPSAB1
SCHEMBL6780268 0.81 F10 (0.46) RAB9AKMT2AGAAPOLBF10
SCHEMBL6778829 0.80 ADRA1D (0.43) KMT2AGAALMNATSHR
SCHEMBL6774764 0.79 F2 (0.55) KMT2AGAAPOLBF10LMNA

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 RAB9A 1872/4885KMT2A 4159/4885GAA 628/4885

“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.