SCHEMBL9623931

SCHEMBL9623931

O=C(O)c1ccc(OC(CCCOc2ccccc2Cl)C(=O)O)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
HPGD P15428 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 2/20 0.48
NFKB1 P19838 2/20 0.48
NFKB2 Q00653 2/20 0.48
RELA Q04206 2/20 0.48
MITF O75030 1/20 0.48
XBP1 P17861 1/20 0.48
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
PPARA Q07869 2/20 0.47
POLB P06746 2/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
FOLH1 Q04609 1/20 0.44
MRGPRX4 Q96LA9 3/20 0.44

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
SCHEMBL9623483 0.87 MEN1 (0.46) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL10898632 0.80 MAPT (0.43) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL9623914 0.79 PPARG (0.51) RAB9APPARAPPARGFOLH1MRGPRX4
SCHEMBL9623316 0.79 PPARA (0.46) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL9623318 0.79 TDP1 (0.49) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9623565 0.77 TP53 (0.43) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL9623616 0.76 RXRA (0.51) MEN1KMT2ASMN1; SMN2RXRARXRB
SCHEMBL337560 0.76 MRGPRX4 (0.58) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL9623613 0.75 FOLH1 (0.51) SMN1; SMN2TP53PPARAPOLBPPARG
SCHEMBL9622883 0.75 FOLH1 (0.51) RAB9ASMN1; SMN2PPARAPOLBPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212944-B1 MELT-PROCESSABLE AROMATIC COPOLYESTER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-04-08 EP disclosed
US-4746721-A ENGINEERING PLASTICS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1988-05-24 US disclosed