SCHEMBL3223241

SCHEMBL3223241

Cc1ccc(C(=O)Nc2ccc(F)cc2)c(Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ MAPK1 P28482 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ P2RX1 P51575 1/20 0.50
▸ EGFR P00533 4/20 0.49
▸ GBA1 P04062 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ NR3C1 P04150 1/20 0.47
▸ NPY1R P25929 1/20 0.46
▸ NPY2R P49146 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL7131171 0.88 EGFR (0.55) RAB9ANPC1GAAHTTEGFR
SCHEMBL3220194 0.85 RAB9A (0.54) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL27803739 0.82 NPC1 (0.50) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL4487889 0.81 TAS1R3 (0.55) RAB9ANPC1ALDH1A1MAPK1HTT
SCHEMBL6830891 0.80 EGFR (0.44) SMN1; SMN2RAB9ANPC1GAAEGFR
SCHEMBL11557801 0.77 EGFR (0.56) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL30421262 0.77 NFKB1 (0.61) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL28557381 0.77 NFKB1 (0.61) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL27803821 0.76 BRAF (0.51) SMN1; SMN2RAB9ANPC1ALDH1A1GAA
SCHEMBL14469060 0.76 EGFR (0.57) SMN1; SMN2ALDH1A1GAAMAPK1EGFR

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-20100063105-A1 PHARMACEUTICAL USES AND SYNTHESIS OF NICOTINANILIDE-N-OXIDES UCB SA (GB) 2010-03-11 — — US disclosed
US-7141590-B2 Pharmaceutical uses and synthesis of nicotinanilide-N-oxides UCB SA (GB) 2006-11-28 — — US disclosed
US-20050026965-A1 Pharmaceutical uses and synthesis of nicotinanilide-N-oxides DARWIN DISCOVERY LIMITED (GB) 2005-02-03 — — US disclosed
US-20030004189-A1 Pharmaceutical uses and synthesis of nicotinanilide-N-oxides DARWIN DISCOVERY LTD. (GB) 2003-01-02 — — US disclosed
WO-2002053544-A1 PHARMACEUTICAL USES AND SYNTHESIS OF NICOTINANILIDE-N-OXIDES DARWIN DISCOVERY LTD. (GB) 2002-07-11 — — 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 (3 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-20100063105-A1 PHARMACEUTICAL USES AND SYNTHESIS OF NICOTINANILIDE-N-OXIDES NNT, NAPRT, NNMT SMN1; SMN2 976/4885RAB9A 1926/4885NPC1 394/4885
US-20030004189-A1 Pharmaceutical uses and synthesis of nicotinanilide-N-oxides NNT, NAPRT, NNMT SMN1; SMN2 976/4885RAB9A 1926/4885NPC1 394/4885
US-20050026965-A1 Pharmaceutical uses and synthesis of nicotinanilide-N-oxides NNT, NAPRT, NNMT SMN1; SMN2 976/4885RAB9A 1926/4885NPC1 394/4885

“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.

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