SCHEMBL10272870

SCHEMBL10272870

CO/N=C(\C)c1cccc(CCCO/N=C(\C)c2cccc(CCCOCc3ccccc3)n2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
PPARA Q07869 4/20 0.35
PPARG P37231 3/20 0.35
BRD4 O60885 1/20 0.33
KCNH2 Q12809 1/20 0.33
EPHX2 P34913 1/20 0.32
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
PTGER1 P34995 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
SCHEMBL10272878 0.85 KCNH2 (0.35) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL10272874 0.83 KCNH2 (0.34) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL10272877 0.83 KCNH2 (0.36) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL16172520 0.83 KCNH2 (0.35) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL10273816 0.83 PDE10A (0.36) RAB9APPARAPPARGMEN1KMT2A
SCHEMBL10272867 0.83 SMN1; SMN2 (0.47) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL882894 0.82 HSP90AA1 (0.38) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL10273020 0.82 KCNH2 (0.30) KCNH2
SCHEMBL882699 0.81 NPC1 (0.35) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL10273019 0.81 LIPG (0.33) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA

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 L3MBTL1 1422/4885TDP1 2840/4885NPC1 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.