SCHEMBL12557352

SCHEMBL12557352

COC(=O)NOc1cc(/C(C)=N/OCc2cccc(Cl)c2)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ PPARG P37231 7/20 0.50
▸ PPARA Q07869 6/20 0.50
▸ MAOA P21397 2/20 0.44
▸ MAOB P27338 2/20 0.44
▸ BRD4 O60885 1/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ RXRG P48443 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ THRB P10828 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TP53 P04637 1/20 0.38

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
SCHEMBL12557348 0.92 NPC1 (0.49) NPC1RAB9APPARGPPARASMN1; SMN2
SCHEMBL12557360 0.91 NPC1 (0.47) NPC1RAB9APPARGPPARAMRGPRX4
SCHEMBL12557291 0.91 RAB9A (0.47) NPC1RAB9APPARGPPARAMAOA
SCHEMBL12557353 0.89 RAB9A (0.49) NPC1RAB9APPARGPPARAMAOA
SCHEMBL12557287 0.88 NPC1 (0.45) NPC1RAB9APPARGPPARAMAOB
SCHEMBL12557307 0.88 RAB9A (0.43) NPC1RAB9APPARGPPARAMAOA
SCHEMBL12557293 0.85 S1PR1 (0.47) NPC1RAB9APPARGPPARAMAOB
SCHEMBL12557309 0.85 NPC1 (0.40) NPC1RAB9APPARGPPARASMN1; SMN2
SCHEMBL12557370 0.85 S1PR1 (0.48) NPC1RAB9APPARGPPARABRD4
SCHEMBL12557310 0.84 NPC1 (0.40) NPC1RAB9APPARGPPARASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE NIPPON SODA CO., LTD. (JP) 2011-06-16 — — US disclosed
US-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE NIPPON SODA CO., LTD. (JP) 2011-06-16 — — 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-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE CBR3, CNPY2, NOX3 NPC1 4680/4885RAB9A 4323/4885PPARG 2729/4885

“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.

Send feedback