SCHEMBL4894896

SCHEMBL4894896

CN(C)/C=C/C(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.75
MAPT P10636 10/20 0.70
RAB9A P51151 5/20 0.70
LMNA P02545 5/20 0.70
HPGD P15428 3/20 0.70
CYP1A2 P05177 2/20 0.70
CYP2C19 P33261 2/20 0.70
ALOX12 P18054 1/20 0.70
ALDH1A1 P00352 9/20 0.66
POLB P06746 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
NPC1 O15118 3/20 0.65
HSP90AA1 P07900 1/20 0.65
HTT P42858 3/20 0.65
GAA P10253 3/20 0.63
KMT2A Q03164 2/20 0.62
MEN1 O00255 1/20 0.60

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
SCHEMBL4894903 1.00 RECQL (0.75) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL23251385 0.92 MAPT (0.81) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL425338 0.86 RECQL (1.00) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL29176317 0.86 RECQL (1.00) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL446006 0.86 RECQL (1.00) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL7364598 0.84 MAPT (0.70) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL801273 0.84 MAPT (0.70) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL1186588 0.84 MAPT (0.70) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL1186589 0.84 MAPT (0.70) RECQLMAPTRAB9ALMNAHPGD
SCHEMBL12914243 0.84 MAPT (0.70) RECQLMAPTRAB9ALMNAHPGD

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 8 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
EP-2731430-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2014-05-21 EP disclosed
WO-2014011429-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-01-16 WO disclosed
WO-2013009791-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-01-17 WO 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 RECQL 1300/4885MAPT 3781/4885RAB9A 2618/4885
US-20160229818-A1 Compounds for Nonsense Suppression, and Methods for Their Use NSUN2, UPF1, NSUN3 RECQL 1300/4885MAPT 3781/4885RAB9A 2618/4885

“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.