SCHEMBL4628446

SCHEMBL4628446

Cc1ccc(C(=O)NC(=N)Nc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.54
SCN2A Q99250 1/20 0.54
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TRPV1 Q8NER1 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 2/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.45
SIRT1 Q96EB6 1/20 0.45

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
SCHEMBL3074365 0.89 NPC1 (0.67) RAB9ANPC1LMNAKDM4EALDH1A1
SCHEMBL4628487 0.89 SMN1; SMN2 (0.52) RAB9ANPC1LMNAKDM4EEGFR
SCHEMBL4629403 0.87 CRHBP (0.52) RAB9ANPC1LMNAKDM4EEGFR
SCHEMBL4628721 0.85 RAB9A (0.63) RAB9ANPC1LMNAKDM4EALDH1A1
SCHEMBL12218081 0.85 RAB9A (0.76) SCN5ASCN2ARAB9ANPC1LMNA
SCHEMBL4628517 0.82 SCN5A (0.57) SCN5ASCN2ARAB9ANPC1LMNA
SCHEMBL4629422 0.82 MEN1 (0.52) RAB9ANPC1LMNAKDM4EMAPT
SCHEMBL4629228 0.81 NPC1 (0.56) RAB9ANPC1MAPTSMN1; SMN2TRPV1
SCHEMBL4629385 0.78 SMN1; SMN2 (0.51) RAB9ANPC1LMNAALDH1A1MAPT
SCHEMBL23844169 0.78 LMNA (0.76) RAB9ANPC1LMNAKDM4EEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 EP claimed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 US claimed
EP-1918272-A1 Pharmaceutically active compounds and methods of use Wyeth a Corporation of the State of Delaware (US) 2008-05-07 EP disclosed
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 EP disclosed
US-20060270741-A1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-11-30 US disclosed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 US disclosed
EP-1032556-A4 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE INC (US) 2005-02-02 EP disclosed
EP-1032556-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 2000-09-06 EP disclosed
WO-1999020599-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-04-29 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 (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-20060270741-A1 Pharmaceutically active compounds and methods of use GBA1, CTSA, GAA SCN5A 1196/4885SCN2A 1613/4885RAB9A 617/4885

“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.