SCHEMBL10286209

SCHEMBL10286209

Cc1nc2c(cc1N(C)C)CCCCC2=O

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL10286567 0.97 HRH3 (0.33) HPGDHRH3
SCHEMBL10286156 0.80 NPC1 (0.34) NPC1HPGDRAB9A
SCHEMBL10286474 0.76 KDM4E (0.33) NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL10286109 0.75 HSD17B1 (0.34)
SCHEMBL10286115 0.74 ALDH1A1 (0.41) NPC1MAPTHPGDSMN1; SMN2
SCHEMBL10286537 0.73 OPRM1 (0.37) MAPTHPGDSMN1; SMN2
SCHEMBL10286492 0.73 KDM4E (0.32) MAPTHPGDHRH3
SCHEMBL10286597 0.73 ALDH1A1 (0.34) MAPTHPGD
SCHEMBL10286551 0.73 KDM4E (0.38) MAPTHPGDSMN1; SMN2
SCHEMBL10286478 0.73 MAOA (0.39) MAPTHPGDSMN1; 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-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
US-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
WO-2012001040-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2012-01-05 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-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES MSR1, DDT, MPO NPC1 3975/4885MAPT 4719/4885HPGD 1600/4885

“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.