SCHEMBL5434359

SCHEMBL5434359

NCC(CNC(=O)c1ccc(N2CCCCC2=O)cc1)NC(=O)c1ccc(Cl)s1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.61
F2 P00734 1/20 0.61
ALDH1A1 P00352 2/20 0.51
MAPT P10636 2/20 0.51
HPGD P15428 2/20 0.51
RAB9A P51151 1/20 0.51
PRMT5 O14744 1/20 0.48
LMNA P02545 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL5436928 0.97 F10 (0.60) F10F2ALDH1A1MAPTHPGD
SCHEMBL5438397 0.93 F10 (0.61) F10F2ALDH1A1MAPTHPGD
SCHEMBL5445218 0.91 F10 (0.59) F10F2ALDH1A1MAPTHPGD
SCHEMBL5433301 0.91 F10 (0.59) F10F2ALDH1A1MAPTHPGD
SCHEMBL5443288 0.89 F10 (0.57) F10F2ALDH1A1MAPTHPGD
SCHEMBL5440326 0.89 F10 (0.57) F10F2ALDH1A1MAPTHPGD
SCHEMBL5431556 0.89 F10 (0.56) F10F2ALDH1A1MAPTHPGD
SCHEMBL5438932 0.88 F10 (0.64) F10F2ALDH1A1MAPTHPGD
SCHEMBL5430538 0.87 F10 (0.59) F10F2ALDH1A1MAPTHPGD
SCHEMBL5433737 0.87 F10 (0.59) F10F2ALDH1A1MAPTHPGD

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 46/4885F2 6/4885ALDH1A1 1204/4885

“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.