SCHEMBL6242548

SCHEMBL6242548

C=C(c1ccc(NC(=O)OC(C)(C)C)c(C)c1)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 2/20 0.42
ABCC8 Q09428 2/20 0.42
KCNJ11 Q14654 2/20 0.42
KCNJ8 Q15842 2/20 0.42
CYP17A1 P05093 1/20 0.42
LCK P06239 6/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
BRD9 Q9H8M2 1/20 0.36
CISD2 Q8N5K1 1/20 0.36

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
SCHEMBL6240779 0.88 ABCC9 (0.43) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL5151365 0.80 ABCC9 (0.44) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL30587156 0.78 MAPT (0.46) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL628865 0.78 MAPT (0.46) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL11959276 0.77 LCK (0.49) CYP17A1LCKSMN1; SMN2ATMTAS1R3
SCHEMBL6243514 0.77 RXFP1 (0.41) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL6237795 0.77 RAB9A (0.42) ABCC9ABCC8KCNJ11KCNJ8CYP17A1
SCHEMBL6244352 0.76 TAS1R3 (0.43) CYP17A1SMN1; SMN2POLBTAS1R3TAS1R1
SCHEMBL29803307 0.75 RXFP1 (0.55) SMN1; SMN2RXFP1POLBCISD2
SCHEMBL7667607 0.75 RXFP1 (0.55) SMN1; SMN2RXFP1POLBCISD2

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-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-11-10 US disclosed
EP-1538138-A1 SUBSTITUTED BENZANILIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2005-06-08 EP 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-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent GCN1, L3MBTL3, L3MBTL4 ABCC9 1010/4885ABCC8 947/4885KCNJ11 1324/4885

“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.