SCHEMBL14745187

SCHEMBL14745187

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

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 5/20 0.35
PLA2G2A P14555 2/20 0.34
TP53 P04637 1/20 0.33
EGLN1 Q9GZT9 3/20 0.33
SLC33A1 O00400 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GHSR Q92847 1/20 0.32
NR3C2 P08235 1/20 0.32
ALOX5 P09917 1/20 0.32

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
SCHEMBL14744829 0.88 EDNRB (0.39) EDNRBPLA2G2ATP53EGLN1KDM4E
SCHEMBL14744705 0.86 EDNRB (0.34) EDNRBPLA2G2ATP53EGLN1ALDH1A1
SCHEMBL14745062 0.78 NPC1 (0.36) EDNRBTP53KDM4EALDH1A1GHSR
SCHEMBL14744752 0.78 NR3C2 (0.37) EDNRBTP53NR3C2
SCHEMBL14744667 0.78 L3MBTL1 (0.34) EDNRBPLA2G2ATP53EGLN1ALDH1A1
SCHEMBL14745242 0.77 EDNRB (0.44) EDNRBPLA2G2ATP53KDM4EALDH1A1
SCHEMBL14744693 0.76 L3MBTL1 (0.38) EDNRBPLA2G2ATP53EGLN1ALDH1A1
SCHEMBL16568122 0.75 MEN1 (0.41) EDNRBEGLN1KDM4EALDH1A1
SCHEMBL14745742 0.74 EGLN1 (0.35) EDNRBTP53EGLN1KDM4EALDH1A1
SCHEMBL14745836 0.73 MAPT (0.31) TP53KDM4EALDH1A1

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 3885/4885PLA2G2A 2737/4885TP53 2640/4885

“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.