SCHEMBL5448264

SCHEMBL5448264

O=C(CC(NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)N1CCOCC1)Nc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
F10 P00742 12/20 0.48
F2 P00734 1/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
GPR55 Q9Y2T6 1/20 0.43
NAMPT P43490 1/20 0.43

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
SCHEMBL5433247 0.94 MAPT (0.54) MAPTF10F2ALDH1A1HPGD
SCHEMBL5439034 0.93 MAPT (0.53) MAPTF10F2ALDH1A1HPGD
SCHEMBL5433534 0.90 F10 (0.50) MAPTF10F2ALDH1A1HPGD
SCHEMBL5439334 0.89 MAPT (0.49) MAPTF10F2RAB9ANAMPT
SCHEMBL5439338 0.89 MAPT (0.49) MAPTF10F2RAB9ANAMPT
SCHEMBL5440638 0.88 F10 (0.56) MAPTF10ALDH1A1HPGD
SCHEMBL5440482 0.86 EPHX2 (0.53) MAPTF10F2ALDH1A1NPC1
SCHEMBL5439138 0.85 MAPT (0.49) MAPTF10F2ALDH1A1HPGD
SCHEMBL5434264 0.84 MAPT (0.52) MAPTF10F2ALDH1A1HPGD
SCHEMBL5428400 0.83 MAPT (0.56) MAPTF10F2ALDH1A1HPGD

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-20070129361-A1 LACTAM-CONTAINING DIAMINOALKYL, Beta-AMINOACIDS, Alpha-AMINOACIDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS QIAO JENNIFER X 2007-06-07 US claimed
US-20070129361-A1 LACTAM-CONTAINING DIAMINOALKYL, Beta-AMINOACIDS, Alpha-AMINOACIDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS QIAO JENNIFER X 2007-06-07 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-20070129361-A1 LACTAM-CONTAINING DIAMINOALKYL, Beta-AMINOACIDS, Alpha-AMINOACIDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS PEPD, XPNPEP1, METAP1 MAPT 4212/4885F10 46/4885F2 6/4885

“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.