SCHEMBL14744820

SCHEMBL14744820

CCc1ccc(=O)[nH]c1-c1ccc2c(c1)cc(CO)n2C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.35
PARP1 P09874 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
MAOA P21397 1/20 0.33
HCAR1 Q9BXC0 1/20 0.32
MAPK14 Q16539 2/20 0.31
PDE10A Q9Y233 3/20 0.31

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
SCHEMBL16428963 0.88 HCAR1 (0.32) HCAR1MAPK14
SCHEMBL16428711 0.87 BRPF1 (0.32) HCAR1MAPK14
SCHEMBL14745338 0.81 TNKS (0.34) TNKSPARP1TNKS2MAOA
SCHEMBL16428845 0.74 MAPK14 (0.36) MAPK14
SCHEMBL14741229 0.74 TNKS (0.33) TNKSPARP1TNKS2
SCHEMBL17597895 0.73 MCHR1 (0.30)
SCHEMBL16428916 0.73 MCHR1 (0.31)
SCHEMBL14745645 0.71 MAPT (0.39) TNKSPARP1TNKS2
SCHEMBL14741077 0.71 CNR2 (0.31)
Hydrochloric Acid SCHEMBL14745283 0.71 CNR2 (0.31)

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 TNKS 1774/4885PARP1 2143/4885TNKS2 1896/4885

“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.