SCHEMBL7540381

SCHEMBL7540381

CNc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)c(C(=O)O)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
TSHR P16473 1/20 0.50
AVPR2 P30518 1/20 0.50
GPR27 Q9NS67 1/20 0.50
WDR5 P61964 2/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 2/20 0.45
S100A9 P06702 1/20 0.44
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
ALPL P05186 1/20 0.43
HDAC3 O15379 2/20 0.43
HDAC4 P56524 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC7 Q8WUI4 2/20 0.43

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
SCHEMBL6679996 0.88 POLB (0.67) POLBTSHRAVPR2GPR27WDR5
SCHEMBL7542193 0.87 POLB (0.48) POLBTSHRAVPR2GPR27WDR5
SCHEMBL6676028 0.86 LMNA (0.62) POLBTSHRWDR5MEN1KMT2A
SCHEMBL1813497 0.85 TNNI3K (0.47) POLBTSHRAVPR2GPR27MAPK1
SCHEMBL6678325 0.84 TSHR (0.57) POLBTSHRWDR5MEN1KMT2A
SCHEMBL6675565 0.84 TSHR (0.57) POLBTSHRWDR5MEN1KMT2A
SCHEMBL5372090 0.79 SMN1; SMN2 (0.51) POLBWDR5MEN1KMT2APKM
SCHEMBL4425900 0.78 LMNA (0.54) MAPK1SMN1; SMN2LMNA
SCHEMBL5320408 0.76 POLB (0.69) POLBSMN1; SMN2LMNAHDAC3HDAC4
SCHEMBL3948390 0.76 KIF11 (0.50) AVPR2GPR27

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US claimed

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-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 POLB 638/4885TSHR 4093/4885AVPR2 4702/4885

“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.