SCHEMBL5424142

SCHEMBL5424142

CCOC(=O)n1c(=O)n(C)c2ccc(Br)cc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.71
L3MBTL1 Q9Y468 3/20 0.71
ALDH1A1 P00352 3/20 0.65
PARG Q86W56 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
ATM Q13315 1/20 0.42
APAF1 O14727 1/20 0.42
SMAD3 P84022 1/20 0.42
GAA P10253 2/20 0.41
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
GLA P06280 1/20 0.40
KDM1A O60341 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL28965644 0.82 ALDH1A1 (0.54) LMNAL3MBTL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL31710152 0.82 LMNA (0.48) LMNAL3MBTL1ALDH1A1PARGSMN1; SMN2
SCHEMBL15999448 0.77 HSD17B10 (0.60) LMNAL3MBTL1ALDH1A1PARGGAA
SCHEMBL5418830 0.76 CCNB2 (0.44) LMNAL3MBTL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL7479161 0.74 MCL1 (0.47) LMNAL3MBTL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL474471 0.74 MEN1 (0.55) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5431370 0.73 ALDH1A1 (0.51) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL28965728 0.73 ALDH1A1 (0.60) LMNAL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL27034561 0.72 ALDH1A1 (0.42) LMNAL3MBTL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL17845670 0.71 PARG (1.00) PARG

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-20070191447-A1 Novel heterocyclic compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-08-16 US disclosed
EP-1719761-A1 NOVEL HETEROCYCLIC COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-11-08 EP disclosed
US-20030225127-A1 Heterocyclic sulfonamide derivatives BENDER DAVID MICHAEL (US) 2003-12-04 US disclosed
EP-1309577-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2003-05-14 EP disclosed
WO-2002014294-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2002-02-21 WO 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 (2 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-20070191447-A1 Novel heterocyclic compound OPRD1, GRIN3A, GRM3 LMNA 3597/4885L3MBTL1 4071/4885ALDH1A1 1154/4885
US-20030225127-A1 Heterocyclic sulfonamide derivatives GRIN2A, GRIN2B, GRIN1 LMNA 4816/4885L3MBTL1 4768/4885ALDH1A1 552/4885

“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.