SCHEMBL10082863

SCHEMBL10082863

CCc1cccc(NC(=O)NCCc2ccc(OC)cc2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.59
TRPV1 Q8NER1 1/20 0.55
CNR1 P21554 1/20 0.54
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
PKM P14618 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
MAPK1 P28482 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
HTT P42858 1/20 0.50
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
GLA P06280 1/20 0.50
LMNA P02545 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CHRNB2 P17787 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48

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
SCHEMBL10084546 0.87 KDM4E (0.51) FPR2TRPV1CNR1KMT2AALDH1A1
SCHEMBL10082147 0.86 CNR1 (0.50) FPR2CNR1KMT2AMEN1PKM
SCHEMBL10068143 0.83 FPR2 (0.58) FPR2TRPV1CNR1KMT2AALDH1A1
SCHEMBL10083290 0.80 CHRNB2 (0.54) KMT2AALDH1A1MEN1SMN1; SMN2MAPK1
SCHEMBL10082882 0.80 CHRNB2 (0.52) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL91611 0.78 FPR2 (0.55) FPR2TRPV1CNR1KMT2ASMN1; SMN2
SCHEMBL10083286 0.78 CHRNB2 (0.75) KMT2AMEN1PKMSMN1; SMN2NPC1
SCHEMBL30858767 0.76 SMN1; SMN2 (0.77) FPR2CNR1KMT2AALDH1A1SMN1; SMN2
SCHEMBL10083506 0.76 HTT (0.57) ALDH1A1SMN1; SMN2NPC1RAB9AHTT
SCHEMBL16562079 0.76 FPR2 (0.86) FPR2CNR1KMT2AALDH1A1MEN1

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-8119646-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090258875-A1 Fungicide Hydroximoyl-Tetrazole Derivatives BAYER CROPSCIENCE AG (DE) 2009-10-15 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-20090258875-A1 Fungicide Hydroximoyl-Tetrazole Derivatives HAAO, CYP51A1, CYP8B1 FPR2 3163/4885TRPV1 3951/4885CNR1 3069/4885

“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.