SCHEMBL6555829

SCHEMBL6555829

Cc1cc(C(=O)NC(CC(=O)O)c2cc(C#N)ccc2O)ccc1C(=O)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.42
CTSA P10619 9/20 0.41
EGLN1 Q9GZT9 2/20 0.37
EGLN2 Q96KS0 1/20 0.37
FASN P49327 5/20 0.37
PIN1 Q13526 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
SCHEMBL6554526 0.85 NAMPT (0.43) ACACBCTSAPIN1
SCHEMBL7560667 0.85 F10 (0.41) ACACBCTSA
Hydrochloric Acid SCHEMBL7558907 0.84 F10 (0.41) ACACBCTSA
SCHEMBL6340535 0.77 SLC6A9 (0.44) ACACB
SCHEMBL7566304 0.77 ACACB (0.41) ACACBFASN
SCHEMBL6342009 0.76 NAMPT (0.43) CTSAEGLN1EGLN2PIN1
SCHEMBL6554528 0.76 NAMPT (0.43) ACACB
SCHEMBL6554476 0.75 SLC6A9 (0.45) ACACB
SCHEMBL6556808 0.74 ACACB (0.53) ACACBFASN
Hydrochloric Acid SCHEMBL6556783 0.74 ITGB3 (0.41) ACACB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390357-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-02-25 EP disclosed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US disclosed
WO-2002062778-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-15 WO 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-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 ACACB 2861/4885CTSA 2783/4885EGLN1 63/4885

“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.