SCHEMBL4882773

SCHEMBL4882773

COc1cccc(C(C=NO)=NNC(=O)c2cccc(Br)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 2/20 0.50
KMT2A Q03164 2/20 0.50
OGG1 O15527 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
MTOR P42345 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MITF O75030 1/20 0.47
AGTR1 P30556 1/20 0.47
OPRK1 P41145 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 5/20 0.47
CCR6 P51684 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47

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
SCHEMBL4882768 1.00 LMNA (0.52) LMNAHPGDHTTKMT2AOGG1
SCHEMBL4882310 0.91 MAOA (0.55) LMNAHPGDKMT2AOGG1CYP1A2
SCHEMBL4882302 0.91 MAOA (0.55) LMNAHPGDKMT2AOGG1CYP1A2
SCHEMBL4887228 0.88 NPC1 (0.57) LMNAHTTKMT2ASMN1; SMN2NPC1
SCHEMBL4881965 0.88 NPC1 (0.57) LMNAHTTKMT2ASMN1; SMN2NPC1
SCHEMBL4881966 0.88 NPC1 (0.57) LMNAHTTKMT2ASMN1; SMN2NPC1
SCHEMBL4887230 0.88 NPC1 (0.57) LMNAHTTKMT2ASMN1; SMN2NPC1
SCHEMBL4878016 0.84 NPC1 (0.59) HTTKMT2AOGG1CYP1A2CYP3A4
SCHEMBL4878014 0.84 NPC1 (0.59) HTTKMT2AOGG1CYP1A2CYP3A4
SCHEMBL4876180 0.83 MTOR (0.58) KMT2AOGG1CYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227787-A1 Use of New Lipoxygenase Inhibitors BIOLIPOX AB (SE) 2008-09-18 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-20080227787-A1 Use of New Lipoxygenase Inhibitors ALOX15, ALOX15B, ALOX12 LMNA 2096/4885HPGD 41/4885HTT 2819/4885

“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.