SCHEMBL5433368

SCHEMBL5433368

COCCC(N)CNC(=O)c1ccc(-n2ccncc2=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
AKT1 P31749 1/20 0.39
MAPK14 Q16539 1/20 0.38
ADRB2 P07550 2/20 0.38
ADRB1 P08588 2/20 0.38
ADRB3 P13945 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
NAMPT P43490 1/20 0.36
XDH P47989 1/20 0.36
CYP24A1 Q07973 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL5435223 0.81 F10 (0.45) F10MAPK14NAMPT
SCHEMBL5435227 0.81 F10 (0.42) F10AKT1MAPK14HTTNAMPT
SCHEMBL4743775 0.76 HTT (0.60) F10MAPK14ALDH1A1HPGDHTT
SCHEMBL5433501 0.76 F10 (0.46) F10MAPK14ALDH1A1LMNAMAPT
SCHEMBL5433503 0.76 CYP1A2 (0.49) F10MEN1KMT2AMAPK14
SCHEMBL5431440 0.74 F10 (0.46) F10KMT2AAKT1MAPK14HPGD
SCHEMBL5431357 0.73 F10 (0.47) F10KMT2AAKT1MAPK14ALDH1A1
SCHEMBL5433365 0.72 F10 (0.39) F10MEN1KMT2AMAPK14ALDH1A1
SCHEMBL5431351 0.71 F10 (0.46) F10KMT2AMAPK14HPGDMAPT
SCHEMBL5440328 0.71 F10 (0.53) F10HTTLMNANAMPTCYP24A1

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 46/4885MEN1 196/4885KMT2A 2903/4885

“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.