SCHEMBL4878083

SCHEMBL4878083

COC(=O)c1cccc(-c2nc3ccc(C)cc3o2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.76
NPC1 O15118 9/20 0.76
RAB9A P51151 9/20 0.76
ALDH1A1 P00352 8/20 0.76
KDM4E B2RXH2 7/20 0.76
HPGD P15428 7/20 0.76
SMN1; SMN2 Q16637 7/20 0.76
HSD17B10 Q99714 6/20 0.76
NFKB1 P19838 2/20 0.76
NFKB2 Q00653 2/20 0.76
RELA Q04206 2/20 0.76
ATM Q13315 1/20 0.76
GPR119 Q8TDV5 1/20 0.66
TP53 P04637 7/20 0.55
USP2 O75604 1/20 0.54
PKM P14618 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53

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
SCHEMBL18003207 0.87 GPR119 (0.62) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL1675479 0.86 NPC1 (0.64) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL31247990 0.86 KDM4E (0.74) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL28605620 0.86 KDM4E (0.74) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL1675543 0.85 MAPT (0.66) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL9608577 0.82 GPR119 (0.52) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL144958 0.82 MAPT (0.71) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL20897861 0.82 MAPT (0.60) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL20898075 0.82 MAPT (0.60) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL5834871 0.82 RAB9A (0.62) MAPTNPC1RAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269191-A1 Compounds for Nonsense Suppression, Use of These Compounds for the Manufacture of a Medicament for Treating Somatic Mutation-Related Diseases PTC THERAPEUTICS, INC. (US) 2008-10-30 US disclosed
US-20080269191-A1 Compounds for Nonsense Suppression, Use of These Compounds for the Manufacture of a Medicament for Treating Somatic Mutation-Related Diseases PTC THERAPEUTICS, INC. (US) 2008-10-30 US disclosed
EP-1812071-A2 COMPOUNDS FOR NONSENSE SUPPRESSION, USE OF THESE COMPOUNDS FOR THE MANUFACTURE OF A MEDICAMENT FOR TREATING SOMATIC MUTATION-RELATED DISEASES PTC Therapeutics, Inc. (US) 2007-08-01 EP disclosed
WO-2006044503-A2 COMPOUNDS FOR NONSENSE SUPPRESSION, USE OF THESE COMPOUNDS FOR THE MANUFACTURE OF A MEDICAMENT FOR TREATING SOMATIC MUTATION-RELATED DISEASES PTC THERAPEUTICS, INC. (US) 2006-04-27 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-20080269191-A1 Compounds for Nonsense Suppression, Use of These Compounds for the Manufacture of a Medicament for Treating Somatic Mutation-Related Diseases UPF1, NSUN2, RNMT MAPT 2955/4885NPC1 971/4885RAB9A 3411/4885

“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.