SCHEMBL14745268

SCHEMBL14745268

CCc1cc(C(=O)O)c(=O)n(Cc2ccc(OC)cc2OC)c1-c1ccc2c(c1)cc(CCN1CCCC1)n2C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
TSHR P16473 3/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
AADAT Q8N5Z0 1/20 0.37
MEN1 O00255 4/20 0.37
EDNRB P24530 2/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL14745444 0.93 LMNA (0.40) KMT2ATSHRMAPK1ALDH1A1KDM4E
SCHEMBL14745593 0.83 GABRG2 (0.39) ALDH1A1KDM4EMAPTLMNAEDNRB
SCHEMBL14745624 0.81 GABRG2 (0.40) ALDH1A1MAPTLMNAEDNRB
SCHEMBL14745231 0.81 L3MBTL1 (0.36) ALDH1A1KDM4EMAPTLMNAEDNRB
SCHEMBL14744995 0.79 L3MBTL1 (0.36) ALDH1A1KDM4EMAPTLMNAEDNRB
SCHEMBL14745044 0.79 KMT2A (0.41) KMT2ATSHRMAPK1ALDH1A1KDM4E
SCHEMBL14744696 0.77 L3MBTL1 (0.34) ALDH1A1MAPTLMNA
SCHEMBL14745369 0.76 L3MBTL1 (0.39) KMT2AMAPK1ALDH1A1MAPTLMNA
SCHEMBL14741062 0.76 KDM4C (0.41) KMT2ATSHRMAPK1ALDH1A1KDM4E
SCHEMBL14745992 0.76 L3MBTL1 (0.35) ALDH1A1MAPTLMNAAADATEDNRB

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 KMT2A 4450/4885TSHR 4837/4885MAPK1 4357/4885

“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.