SCHEMBL14744689

SCHEMBL14744689

CON(C)C(=O)c1ccc2c(c1)cc(CO[Si](C)(C)C(C)(C)C)n2C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DGAT1 O75907 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL14745668 0.84 HCAR3 (0.40) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL14745543 0.82 SIGMAR1 (0.34) NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL14745203 0.81 HSD17B3 (0.37) NPC1RAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL16441006 0.81 RAB9A (0.39) MLYCDNPC1RAB9AL3MBTL1KDM4E
SCHEMBL14744790 0.76 IDO1 (0.39) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL14745193 0.75 MCL1 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL14697200 0.75 MLYCD (0.46) MLYCDNPC1RAB9AKDM4EALDH1A1
SCHEMBL25256351 0.74 MLYCD (0.38) MLYCDNPC1RAB9AALDH1A1HPGD
SCHEMBL14744974 0.74
SCHEMBL14744975 0.74

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 MLYCD 520/4885NPC1 1233/4885RAB9A 1346/4885

“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.