SCHEMBL1815144

SCHEMBL1815144

O=C(CNc1cccnc1)NC(c1ccccc1Cl)c1cc(Cl)c2cccnc2c1O

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 14/20 0.76
ADAMTS4 O75173 1/20 0.67
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPT P10636 1/20 0.63
MCL1 Q07820 1/20 0.63
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
TP53 P04637 1/20 0.57
POLB P06746 1/20 0.57

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
SCHEMBL1814287 0.91 ADAMTS5 (0.79) ADAMTS5ADAMTS4TP53POLB
SCHEMBL1816754 0.87 ADAMTS5 (0.78) ADAMTS5
SCHEMBL1814193 0.86 ADAMTS5 (0.80) ADAMTS5MEN1KMT2AMCL1HTT
SCHEMBL1813458 0.86 ADAMTS5 (1.00) ADAMTS5ADAMTS4TP53POLB
SCHEMBL1810280 0.86 ADAMTS5 (0.77) ADAMTS5ADAMTS4TP53POLB
SCHEMBL27757701 0.85 ADAMTS5 (0.79) ADAMTS5ADAMTS4TP53POLB
SCHEMBL27757776 0.85 ADAMTS5 (0.66) ADAMTS5MEN1KMT2AMCL1HTT
SCHEMBL1814298 0.84 ADAMTS5 (0.76) ADAMTS5ADAMTS4MEN1KMT2ASMN1; SMN2
SCHEMBL2153807 0.83 ALOX12 (0.75) ADAMTS5ADAMTS4MEN1KMT2AHTT
SCHEMBL1811846 0.83 ADAMTS5 (0.80) ADAMTS5ADAMTS4MEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US claimed
CN-101505751-A 8-hydroxyquinoline compounds and methods thereof WYETH CORP (US) 2009-08-12 CN claimed
US-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 US claimed
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US disclosed
CN-101505751-A 8-hydroxyquinoline compounds and methods thereof WYETH CORP (US) 2009-08-12 CN disclosed
US-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof MMP8, MMP26, MMP9 ADAMTS5 11/4885ADAMTS4 14/4885MEN1 2254/4885

“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.