SCHEMBL4948472

SCHEMBL4948472

C[C@H](O)C(=O)NCc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 2/20 0.51
ERCC4 Q92889 2/20 0.51
KMT2A Q03164 2/20 0.46
TPSAB1 Q15661 2/20 0.46
PLG P00747 1/20 0.46
PRSS1 P07477 1/20 0.46
MEN1 O00255 1/20 0.45
KDM4E B2RXH2 1/20 0.44
F13A1 P00488 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL17667847 1.00 ERCC1 (0.51) ERCC1ERCC4KMT2ATPSAB1PLG
SCHEMBL18887748 0.87 ERCC1 (0.67) ERCC1ERCC4KMT2ATPSAB1PLG
SCHEMBL11294240 0.84 MEN1 (0.61) KMT2AMEN1LMNAHPGD
SCHEMBL9200501 0.84 CARM1 (0.56) ERCC1ERCC4TPSAB1PLGPRSS1
SCHEMBL9199910 0.84 CARM1 (0.56) ERCC1ERCC4TPSAB1PLGPRSS1
SCHEMBL9062437 0.83 KMT2A (0.65) KMT2AMEN1MAPT
SCHEMBL10405578 0.83 KMT2A (0.65) KMT2AMEN1MAPT
SCHEMBL5060920 0.82 KDM4E (0.64) KDM4EF13A1LMNAMAPT
SCHEMBL5411543 0.82 LMNA (0.49) ERCC1ERCC4KMT2ATPSAB1PLG
SCHEMBL5411548 0.82 LMNA (0.49) ERCC1ERCC4KMT2ATPSAB1PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130281387-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2013-10-24 US disclosed
US-20130281387-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2013-10-24 US disclosed
WO-2012054528-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2012-04-26 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-20130281387-A1 Chemosensory Receptor Ligand-Based Therapies GPR119, TAS1R2, TAS2R1 ERCC1 3907/4885ERCC4 4486/4885KMT2A 3838/4885

“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.