SCHEMBL14745686

SCHEMBL14745686

CCN(CCc1cc2cc3c(cc2n1C)CCCc1c(O)c(C(=O)O)c(=O)n(Cc2ccc(OC)cc2OC)c1-3)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 5/20 0.35
P2RX3 P56373 1/20 0.34
TSHR P16473 1/20 0.33
AADAT Q8N5Z0 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
EGLN1 Q9GZT9 3/20 0.31
ALDH1A1 P00352 3/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
AGTR1 P30556 1/20 0.30
AGTR2 P50052 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
SCHEMBL14746023 0.94 P2RX3 (0.34) EDNRBP2RX3TSHRAADATMEN1
SCHEMBL14746260 0.87 EDNRB (0.36) EDNRBP2RX3TSHRAADATMEN1
SCHEMBL16429014 0.85 EDNRB (0.39) EDNRBTSHRAADATMEN1KMT2A
SCHEMBL14746160 0.84 EDNRB (0.39) EDNRBTSHRAADATMEN1KMT2A
SCHEMBL14745846 0.81 P2RX3 (0.32) EDNRBP2RX3EGLN1ALDH1A1MAPT
SCHEMBL14746196 0.81 EDNRB (0.40) EDNRBTSHRMEN1KMT2AEGLN1
SCHEMBL14745934 0.81 EDNRB (0.38) EDNRBTSHRAADATMEN1KMT2A
SCHEMBL18628149 0.80 EDNRB (0.35) EDNRBP2RX3TSHRAADATMEN1
SCHEMBL14746063 0.79 EDNRB (0.38) EDNRBTSHRAADATMEN1KMT2A
SCHEMBL14746181 0.79 EGLN1 (0.37) EDNRBTSHREGLN1ALDH1A1MAPT

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
EP-2750678-B1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS INC (US) 2017-03-22 EP disclosed
US-20150038438-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. 2015-02-05 US disclosed
EP-2750678-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC Therapeutics, Inc. (US) 2014-07-09 EP disclosed
WO-2013033228-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2013-03-07 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-20150038438-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE MRPL21, SLC11A2, CLPP EDNRB 3885/4885P2RX3 3360/4885TSHR 4837/4885

“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.