SCHEMBL5831402

SCHEMBL5831402

O=C(Cc1nsc(NS(=O)(=O)c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)n1)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
SCN9A Q15858 2/20 0.45
POLB P06746 1/20 0.44
HSD11B1 P28845 1/20 0.43
HDAC4 P56524 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
LMNA P02545 3/20 0.39
CNR1 P21554 1/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL5831705 0.86 MAPT (0.52) KMT2APOLBHSD11B1LMNAALDH1A1
SCHEMBL5831281 0.86 KMT2A (0.45) KMT2AHSD11B1LMNAALDH1A1SMN1; SMN2
SCHEMBL5830740 0.85 HSD11B1 (0.46) KMT2AHSD11B1LMNAALDH1A1NPSR1
SCHEMBL5830800 0.85 HSD11B1 (0.51) KMT2APOLBHSD11B1LMNAALDH1A1
SCHEMBL3613225 0.85 HSD11B1 (0.59) KMT2APOLBHSD11B1HDAC4HDAC6
SCHEMBL5830943 0.84 KMT2A (0.47) KMT2APOLBHSD11B1HDAC4HDAC6
SCHEMBL3248621 0.84 KMT2A (0.49) KMT2APOLBHSD11B1HDAC4HDAC6
SCHEMBL5830646 0.84 HSD11B1 (0.50) KMT2ASCN9AHSD11B1LMNAALDH1A1
SCHEMBL5831527 0.83 ALDH1A1 (0.54) KMT2APOLBHSD11B1LMNAALDH1A1
SCHEMBL5831227 0.83 HSD11B1 (0.44) KMT2AHSD11B1LMNAALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074788-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2006-07-11 US claimed
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics BIOVITRUM AB (SE) 2003-07-10 US claimed
US-7074788-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2006-07-11 US disclosed
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics BIOVITRUM AB (SE) 2003-07-10 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-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics CPT1A, HSD11B1, CES1 KMT2A 2980/4885SCN9A 2228/4885POLB 2866/4885

“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.