SCHEMBL14745242

SCHEMBL14745242

CCc1c(O)c(C(=O)O)c(=O)n(Cc2ccc(OC)cc2OC)c1-c1ccc2c(c1)c(F)c(C=O)n2C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 11/20 0.44
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TP53 P04637 1/20 0.37
PLA2G2A P14555 1/20 0.36
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL14744608 0.84 EDNRB (0.42) EDNRBALDH1A1KDM4EMEN1POLB
SCHEMBL14744829 0.82 EDNRB (0.39) EDNRBALDH1A1KDM4ETP53PLA2G2A
SCHEMBL14744669 0.80 EDNRB (0.43) EDNRBALDH1A1KDM4EPLA2G2AHPGD
SCHEMBL14745187 0.77 EDNRB (0.35) EDNRBALDH1A1KDM4ETP53PLA2G2A
SCHEMBL14746180 0.75 EDNRB (0.46) EDNRBTP53
SCHEMBL14745297 0.74 EDNRB (0.41) EDNRBALDH1A1KDM4EHPGD
SCHEMBL14745163 0.74 EDNRB (0.40) EDNRBALDH1A1KDM4ETP53MEN1
SCHEMBL14744693 0.73 L3MBTL1 (0.38) EDNRBALDH1A1TP53PLA2G2AMAPT
SCHEMBL14744918 0.72 AADAT (0.38) EDNRBALDH1A1KDM4EMEN1MAPT
SCHEMBL16568122 0.71 MEN1 (0.41) EDNRBALDH1A1KDM4EMEN1POLB

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-9409905-B2 Antibacterial compounds and methods for use PTC THERAPEUTICS, INC. (US) 2016-08-09 US disclosed
US-20150038437-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2015-02-05 US disclosed
EP-2750504-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC Therapeutics, Inc. (US) 2014-07-09 EP disclosed
WO-2013033258-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-20150038437-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE MRPL21, SLC11A2, CLPP EDNRB 3885/4885ALDH1A1 3792/4885KDM4E 4305/4885

“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.