SCHEMBL4258700

SCHEMBL4258700

CCCCCc1cc2ccccc2n1C(C)=O

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OXER1 Q8TDS5 17/20 0.68
▸ AGTR1 P30556 1/20 0.45
▸ AGTR2 P50052 1/20 0.45
▸ POLB P06746 1/20 0.41
▸ PLA2G4A P47712 1/20 0.40

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
SCHEMBL13064049 0.85 OXER1 (0.86) OXER1
SCHEMBL286754 0.81 OXER1 (1.00) OXER1
SCHEMBL3704023 0.81 OXER1 (0.88) OXER1
SCHEMBL30712266 0.80 OXER1 (0.64) OXER1
SCHEMBL286930 0.80 OXER1 (1.00) OXER1
SCHEMBL287576 0.80 OXER1 (1.00) OXER1
SCHEMBL286909 0.80 OXER1 (1.00) OXER1
SCHEMBL286740 0.80 OXER1 (1.00) OXER1
SCHEMBL31435523 0.80 OXER1 (0.67) OXER1AGTR1AGTR2
SCHEMBL287375 0.79 OXER1 (0.98) OXER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473786-B1 Methods and systems for preparing fused heterocyclic compounds using copper(I) catalysts UNIVERSITY OF MASSACHUSETTS (US) 2009-01-06 — — US disclosed
US-20080039625-A1 Screening Methods LAUTENS MARK 2008-02-14 — — US disclosed
EP-1817283-A1 2-SUBSTITUTED INDOLES, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF Lautens, Mark (CA) 2007-08-15 — — EP disclosed
WO-2006047888-A1 2-SUBSTITUTED INDOLES, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF LAUTENS MARK (CA) 2006-05-11 — — 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-20080039625-A1 Screening Methods CBR3, ZKSCAN2, CRBN OXER1 168/4885AGTR1 609/4885AGTR2 546/4885

“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.

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