SCHEMBL4890597

SCHEMBL4890597

O=C(O)c1ccc(-c2nccc(C3=COC=C(C4=CC=CCC4)O3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.36
CAMK2D Q13557 4/20 0.34
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
PRNP P04156 1/20 0.32
GAA P10253 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.31
MAPK8 P45983 2/20 0.31
PIK3CG P48736 2/20 0.31
CAMKK2 Q96RR4 2/20 0.31
GSK3B P49841 1/20 0.31
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL4890552 0.89 PIK3CD (0.36) CAMK2DMEN1KMT2AKDM4EPOLB
SCHEMBL3592782 0.73
SCHEMBL182187 0.73 MAP4K4 (0.32) MAP4K4MEN1KMT2ANPC1RAB9A
SCHEMBL8522061 0.71 MEN1 (0.36) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL3222942 0.71 KDM4E (0.46) MEN1KMT2AKDM4EPOLBGAA
SCHEMBL619635 0.70
SCHEMBL3616817 0.70 MAPKAPK2 (0.35)
SCHEMBL4085337 0.70 TGFBR1 (0.34) MAP4K4KDM4EMAPT
SCHEMBL6246679 0.68 KMT2A (0.35) MEN1KMT2AKDM4EPOLBGAA
SCHEMBL2127673 0.67 ALDH1A1 (0.46) MAP4K4MEN1KMT2AKDM4EPOLB

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-20160229818-A1 Compounds for Nonsense Suppression, and Methods for Their Use PTC THERAPEUTICS, INC. (US) 2016-08-11 US disclosed
US-9315467-B2 Compounds for nonsense suppression, and methods for their use PTC THERAPEUTICS, INC. (US) 2016-04-19 US disclosed
US-20080119473-A1 Compounds for Nonsense Suppression, and Methods for Their Use PTC THERAPEUTICS, INC. 2008-05-22 US disclosed
EP-1799212-A2 COMPOUNDS FOR NONSENSE SUPPRESSION, AND METHODS FOR THEIR USE PTC Therapeutics, Inc. (US) 2007-06-27 EP disclosed
WO-2006044505-A2 COMPOUNDS FOR NONSENSE SUPPRESSION, AND METHODS FOR THEIR USE 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 (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-20080119473-A1 Compounds for Nonsense Suppression, and Methods for Their Use NSUN2, UPF1, NSUN3 MAP4K4 4159/4885CAMK2D 3682/4885MEN1 2836/4885
US-20160229818-A1 Compounds for Nonsense Suppression, and Methods for Their Use NSUN2, UPF1, NSUN3 MAP4K4 4159/4885CAMK2D 3682/4885MEN1 2836/4885

“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.