SCHEMBL7535615

SCHEMBL7535615

C1=NO1.COC(=O)C(COc1cc(C)ccc1C)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
TSHR P16473 3/20 0.43
USP2 O75604 2/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
CYP2C9 P11712 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
GAA P10253 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TTR P02766 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C8 P10632 1/20 0.39

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
SCHEMBL7543571 0.90 TSHR (0.46) SMN1; SMN2TSHRUSP2MAPTALOX15
SCHEMBL7539666 0.87 ALDH1A1 (0.44) SMN1; SMN2TSHRUSP2MAPTALOX15
SCHEMBL8193683 0.81 TSHR (0.52) SMN1; SMN2TSHRUSP2CYP2C9LMNA
SCHEMBL8649258 0.80 SCN4A (0.55) SMN1; SMN2ALOX15TDP1KMT2ACYP1A2
SCHEMBL8200026 0.79 TSHR (0.50) SMN1; SMN2TSHRUSP2CYP2C9LMNA
SCHEMBL7540542 0.78 CYP2C9 (0.41) SMN1; SMN2TSHRUSP2MAPTALOX15
SCHEMBL8197498 0.76 TSHR (0.46) SMN1; SMN2TSHRALOX15CYP2C9LMNA
SCHEMBL7537858 0.76 SCN4A (0.39) SMN1; SMN2TSHRUSP2MAPTALOX15
SCHEMBL27294428 0.75 TSHR (0.41) SMN1; SMN2TSHRMAPTCYP2C9LMNA
SCHEMBL8444033 0.73 KMT2A (0.49) TSHRCYP2C9LMNAMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362212-B1 POTENT FUNGICIDAL ACTIVITY SHIONOGI & COMPANY, LTD. (JP) 2002-03-26 US disclosed
US-20020032227-A1 Oxime derivative and bactericide containing the same as active ingredient TAKASE AKIRA (JP) 2002-03-14 US disclosed
US-6268312-B1 FUNGICIDES SHIONOGI & CO., LTD. (JP) 2001-07-31 US disclosed
US-6048885-A FUNGICIDES SHIONOGI & CO., LTD. (JP) 2000-04-11 US disclosed
EP-0754684-A1 OXIME DERIVATIVE AND BACTERICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SHIONOGI & CO., LTD. (JP) 1997-01-22 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-20020032227-A1 Oxime derivative and bactericide containing the same as active ingredient MSMO1, O60361, CBR1 SMN1; SMN2 2104/4885TSHR 1672/4885USP2 3947/4885

“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.