SCHEMBL14095331

SCHEMBL14095331

COc1cc2nc(Cl)nc(NCCN(C)C)c2cc1OC

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.72
WHR1 P49842 2/20 0.58
EGFR P00533 7/20 0.56
KDR P35968 6/20 0.56
KDM1A O60341 4/20 0.54
RCOR1 Q9UKL0 4/20 0.54
EHMT2 Q96KQ7 4/20 0.54
KMT5A Q9NQR1 3/20 0.54
APP P05067 1/20 0.50

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
SCHEMBL25366062 0.90 HTT (0.59) HTTWHR1EGFRKDRKDM1A
SCHEMBL26530735 0.85 HTT (0.78) HTTEGFRKDREHMT2KMT5A
SCHEMBL20281125 0.84 HTT (0.76) HTTEGFRKDREHMT2KMT5A
SCHEMBL25360755 0.83 HTT (0.60) HTTWHR1EGFRKDRKDM1A
SCHEMBL13975792 0.83 HTT (0.74) HTTEGFRKDREHMT2KMT5A
SCHEMBL14341613 0.82 HTT (0.72) HTTEGFRKDREHMT2KMT5A
SCHEMBL17122655 0.81 HTT (0.70) HTTEGFRKDREHMT2KMT5A
SCHEMBL17122647 0.80 HTT (0.66) HTTEGFRKDREHMT2APP
SCHEMBL17122605 0.79 HTT (0.79) HTTEGFRKDRKDM1ARCOR1
SCHEMBL20266987 0.79 APP (0.71) HTTEGFRKDRAPP

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-7410975-B2 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-08-12 US disclosed
US-7410975-B2 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-08-12 US disclosed
US-20070232622-A1 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GMBH (DE) 2007-10-04 US disclosed
US-20070232622-A1 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GMBH (DE) 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 (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-20070232622-A1 Small molecule toll-like receptor (TLR) antagonists TLR3, TLR8, TLR7 HTT 4396/4885WHR1 3876/4885EGFR 1489/4885

“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.