SCHEMBL3976941

SCHEMBL3976941

CC(NCc1cccc2cc(NS(=O)(=O)c3ccccc3)ccc12)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
AKR1C3 P42330 1/20 0.45
GHSR Q92847 1/20 0.44
CYP2C9 P11712 1/20 0.44
ATIC P31939 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALOX12 P18054 2/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
PTGES O14684 1/20 0.41
HTR6 P50406 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL4006731 0.87 KDM4E (0.44) LMNASMN1; SMN2KMT2AALDH1A1KDM4E
SCHEMBL27776906 0.84 LMNA (0.45) LMNASMN1; SMN2AKR1C3GHSRCYP2C9
SCHEMBL3904385 0.79 LMNA (0.55) LMNASMN1; SMN2AKR1C3ALOX12KMT2A
SCHEMBL3958854 0.78 LMNA (0.48) LMNASMN1; SMN2AKR1C3GHSRCYP2C9
SCHEMBL3906058 0.78 CA1 (0.51) LMNASMN1; SMN2AKR1C3GHSRCYP2C9
SCHEMBL8803006 0.78 KMT2A (0.58) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL3903517 0.78 MAPT (0.42) LMNASMN1; SMN2AKR1C3GHSRALOX12
SCHEMBL3901359 0.76 MAPT (0.46) LMNASMN1; SMN2AKR1C3CYP2C9CYP2C19
SCHEMBL27756096 0.76 LMNA (0.45) LMNASMN1; SMN2AKR1C3GHSRCYP2C9
SCHEMBL3900248 0.75 LMNA (0.56) LMNASMN1; SMN2AKR1C3ALOX12KMT2A

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-7531577-B2 Arylsulfonamidyl tetralin derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2009-05-12 US disclosed
US-20080015208-A1 Arylsulfonamidyl tetralin derivatives and uses thereof ROCHE PALO ALTO LLC 2008-01-17 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-20080015208-A1 Arylsulfonamidyl tetralin derivatives and uses thereof HTR6, TPH1, HTR1B LMNA 2866/4885SMN1; SMN2 825/4885AKR1C3 517/4885

“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.