SCHEMBL15768221

SCHEMBL15768221

NC(Sc1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
PKM P14618 2/20 0.42
ALPI P09923 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR1 O14842 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP2D6 P10635 1/20 0.39
SRC P12931 1/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
SIRT1 Q96EB6 1/20 0.38

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
SCHEMBL15781198 1.00 LMNA (0.43) LMNAPKMALPIPTGS1XIAP
SCHEMBL29013199 0.77 LMNA (0.37) LMNAPKMALPIPTGS1XIAP
SCHEMBL6965136 0.76 LMNA (0.46) LMNAPKMCYP2C9CYP2C19HSD17B10
SCHEMBL11398851 0.76 SIRT1 (0.37) LMNAPKMHSD17B10SMN1; SMN2MAPK1
SCHEMBL14574452 0.75 DPP4 (0.48) LMNAPKMSMN1; SMN2CYP2D6SRC
SCHEMBL18135259 0.75 LMNA (0.42) LMNAPKMSLC7A5CYP2C9CYP2C19
SCHEMBL13845009 0.75 DPP4 (0.48) LMNAPKMSMN1; SMN2CYP2D6SRC
SCHEMBL2033890 0.75 LMNA (0.42) LMNAPKMSLC7A5CYP2C9CYP2C19
SCHEMBL4552643 0.74 LMNA (0.44) LMNAPKMCYP2C9CYP2C19HSD17B10
SCHEMBL74368 0.74 LMNA (0.44) LMNAPKMCYP2C9CYP2C19HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3187488-B1 NOVEL AMINO-PHENYL-SULFONYL-ACETATE DERIVATIVE AND USE THEREOF CJ HEALTHCARE CORP (KR) 2020-02-19 EP disclosed
US-9556469-B2 Method for classifying the presence or absence of a microorganism in a biological medium COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-01-31 US disclosed
US-20140162301-A1 Method for Classifying the Presence or Absence of a Microorganism in a Biological Medium CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-06-12 US disclosed