SCHEMBL10273017

SCHEMBL10273017

CO/N=C(\C)c1cc(CO)cc(CCCO/N=C(\C)c2cccc(C)n2)n1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.32
MET P08581 5/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL882654 0.91 NPC1 (0.32) HSP90AA1METNPC1LMNARAB9A
SCHEMBL10273016 0.88 NPC1 (0.31) HSP90AA1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL882894 0.88 HSP90AA1 (0.38) HSP90AA1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL882639 0.87 HSP90AA1 (0.33) HSP90AA1
SCHEMBL10273015 0.85 KCNH2 (0.35) NPC1LMNARAB9ASMN1; SMN2L3MBTL1
SCHEMBL10273807 0.85 HSP90AA1 (0.37) HSP90AA1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL882870 0.83 PPARA (0.32) HSP90AA1
SCHEMBL16164006 0.81 KCNH2 (0.32)
SCHEMBL883003 0.81 KCNH2 (0.32)
SCHEMBL5020366 0.80 CCR1 (0.41) HSP90AA1NPC1LMNARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140309244-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 US disclosed
US-20140309244-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 US disclosed
WO-2012038521-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-03-29 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-20140309244-A1 NOVEL MICROBIOCIDES MSR1, C3AR1, CD209 HSP90AA1 2350/4885MET 4511/4885NPC1 2400/4885

“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.