SCHEMBL6079199

SCHEMBL6079199

CCO[C@@H](C(=O)NCc1ccc(C(=N)N)cc1)N1Cc2ccc(C)cc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
ST14 Q9Y5Y6 1/20 0.40
F2 P00734 12/20 0.40
ITGB3 P05106 4/20 0.40
ITGA2B P08514 4/20 0.40
F10 P00742 2/20 0.39
PRSS1 P07477 2/20 0.39
F7 P08709 1/20 0.38

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
SCHEMBL6079193 1.00 LMNA (0.41) LMNAST14F2ITGB3ITGA2B
Acetic Acid SCHEMBL6077102 0.97 ITGB3 (0.40) LMNAST14F2ITGB3ITGA2B
SCHEMBL6076798 0.93 ITGB3 (0.43) LMNAST14F2ITGB3ITGA2B
SCHEMBL6076816 0.93 ITGB3 (0.43) LMNAST14F2ITGB3ITGA2B
Acetic Acid SCHEMBL6079106 0.91 ITGB3 (0.43) LMNAF2ITGB3ITGA2BF10
SCHEMBL6030555 0.83 F2 (0.43) ST14F2F10PRSS1F7
SCHEMBL6030558 0.83 F2 (0.43) ST14F2F10PRSS1F7
SCHEMBL6077398 0.83 ST14 (0.41) LMNAST14F2F10PRSS1
SCHEMBL6077410 0.83 ST14 (0.41) LMNAST14F2F10PRSS1
SCHEMBL6077695 0.83 THRB (0.39) LMNAITGB3ITGA2B

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-7056932-B2 Heterocyclyl substituted 1-alkoxy acetic acid amides HOFFMAN-LA ROCHE INC. (US) 2006-06-06 US disclosed
US-20050137168-A1 Heterocyclyl substituted 1-alkoxy acetic acid amides HOFFMANN-LA ROCHE INC. 2005-06-23 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-20050137168-A1 Heterocyclyl substituted 1-alkoxy acetic acid amides F12, TFPI, F11 LMNA 2335/4885ST14 858/4885F2 7/4885

“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.