SCHEMBL10083286

SCHEMBL10083286

CCc1cccc(NC(=O)c2ccc(OC)cc2)n1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.75
CHRNA4 P43681 5/20 0.75
CHRNB4 P30926 4/20 0.75
CHRNA3 P32297 4/20 0.75
ADORA3 P0DMS8 2/20 0.63
F2 P00734 1/20 0.59
NPC1 O15118 5/20 0.57
RAB9A P51151 4/20 0.57
TP53 P04637 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 2/20 0.57
PKM P14618 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
HSD17B10 Q99714 1/20 0.55
F10 P00742 1/20 0.52
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
GRM5 P41594 2/20 0.52

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
SCHEMBL2632145 0.87 ADORA3 (0.74) ADORA3F2NPC1RAB9ATP53
SCHEMBL10084523 0.84 KMT2A (0.70) CHRNB2CHRNA4CHRNB4CHRNA3NPC1
SCHEMBL822127 0.81 ADORA3 (0.63) CHRNB2CHRNA4CHRNB4CHRNA3ADORA3
SCHEMBL10068146 0.78 ADORA3 (0.63) ADORA3F2NPC1RAB9ATP53
SCHEMBL4116110 0.78 CACNA1G (0.54) CHRNB2CHRNA4CHRNB4CHRNA3NPC1
SCHEMBL10082863 0.78 FPR2 (0.59) CHRNB2CHRNA4CHRNB4CHRNA3NPC1
SCHEMBL3111821 0.76 CHRNB2 (0.56) CHRNB2CHRNA4CHRNB4CHRNA3NPC1
SCHEMBL6647475 0.76 SMN1; SMN2 (0.58) CHRNB2CHRNA4CHRNB4CHRNA3NPC1
SCHEMBL10759295 0.75 DEGS1 (0.51) CHRNB2CHRNA4CHRNB4CHRNA3ADORA3
SCHEMBL13779848 0.75 RXFP1 (0.65) CHRNB2CHRNA4CHRNB4CHRNA3NPC1

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 CHRNB2 4648/4885CHRNA4 4289/4885CHRNB4 4707/4885

“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.