SCHEMBL2965562

SCHEMBL2965562

Cc1ccc2c(=O)cc(C)[nH]c2n1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 9/20 0.70
ADORA2A P29274 8/20 0.70

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
SCHEMBL7913595 0.77 ADORA2A (0.79) ADORA1ADORA2A
SCHEMBL1536293 0.77 ADORA2A (1.00) ADORA1ADORA2A
SCHEMBL20561885 0.76 HTT (0.58) ADORA1ADORA2A
SCHEMBL7920486 0.76 ADORA2A (0.76) ADORA1ADORA2A
SCHEMBL7925190 0.75 ADORA2A (1.00) ADORA1ADORA2A
SCHEMBL7921850 0.75 ADORA2A (0.75) ADORA1ADORA2A
SCHEMBL890081 0.74 CCR1 (0.42) ADORA1ADORA2A
SCHEMBL7920165 0.74 ADORA2A (0.77) ADORA1ADORA2A
SCHEMBL7920130 0.73 ADORA2A (0.75) ADORA1ADORA2A
SCHEMBL7922302 0.73 ADORA2A (0.71) ADORA1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-20100256139-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2010-10-07 US disclosed
EP-1979349-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2010-07-28 EP disclosed
US-7763731-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2010-07-27 US disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 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 (2 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-20070232645-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 ADORA1 3948/4885ADORA2A 3844/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 ADORA1 3948/4885ADORA2A 3844/4885

“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.