SCHEMBL5428271

SCHEMBL5428271

CN1CCN(C(=O)C(CC(=O)Nc2ccc(Cl)cn2)NC(=O)c2ccc(N3CCCCC3=O)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.56
TACR3 P29371 1/20 0.46
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL5438477 0.94 F10 (0.60) F10TACR3MAPT
SCHEMBL5428351 0.94 F10 (0.59) F10TACR3MAPTHPGD
SCHEMBL5431385 0.91 F10 (0.55) F10TACR3MAPT
SCHEMBL5431380 0.91 F10 (0.55) F10TACR3MAPT
SCHEMBL5440638 0.91 F10 (0.56) F10TACR3MAPTHPGD
SCHEMBL5433090 0.88 F10 (0.52) F10TACR3MAPT
SCHEMBL5433534 0.88 F10 (0.50) F10MAPTHPGD
SCHEMBL5445224 0.87 F10 (0.57) F10TACR3MAPT
SCHEMBL5439064 0.86 F10 (0.62) F10TACR3MAPTHPGD
SCHEMBL5433708 0.85 F10 (0.52) F10TACR3MAPT

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 F10 46/4885TACR3 2543/4885MAPT 4212/4885

“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.