SCHEMBL4871858

SCHEMBL4871858

Cc1ccc2c(c1)C(=O)CCCN2S(=O)(=O)c1ccccc1C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
CRHBP P24387 2/20 0.44
CRHR2 Q13324 2/20 0.44
TP53 P04637 3/20 0.43
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
GAA P10253 1/20 0.39
HTR6 P50406 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
SCHEMBL7334845 0.87 CRHBP (0.47) L3MBTL1MEN1KMT2AATMCRHBP
SCHEMBL4863822 0.80 L3MBTL1 (0.53) L3MBTL1MEN1KMT2AATMCRHBP
SCHEMBL10536445 0.79 TSHR (0.51) L3MBTL1MEN1KMT2ACRHBPCRHR2
SCHEMBL4871873 0.77 RORC (0.49) MEN1KMT2AATMTP53MAPT
SCHEMBL1495922 0.74 KCNN4 (0.64) MEN1KMT2AATMTP53MAPT
SCHEMBL4868711 0.74 MAPT (0.43) MEN1KMT2ACRHBPCRHR2TP53
SCHEMBL10879279 0.73 GAA (0.50) MEN1KMT2ACRHBPCRHR2SMN1; SMN2
SCHEMBL31585998 0.73 MAPT (0.56) MEN1KMT2ATP53MAPT
SCHEMBL533706 0.73 MAPT (0.56) MEN1KMT2ATP53MAPT
SCHEMBL16628386 0.73 MAPT (0.57) TP53MAPTSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 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-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 L3MBTL1 4626/4885MEN1 651/4885KMT2A 2577/4885

“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.