SCHEMBL9323724

SCHEMBL9323724

CCO[C@H](OC)Oc1ccc(C(=O)C(C)O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
PARP10 Q53GL7 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
PAX8 Q06710 1/20 0.36
ATM Q13315 1/20 0.36
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
PLA2G4B P0C869 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ESR1 P03372 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL9323182 0.79 L3MBTL1 (0.46) KMT2AMEN1LMNAALDH1A1L3MBTL1
SCHEMBL28799901 0.76 PARP10 (0.59) KMT2AMEN1PARP10SMN1; SMN2LMNA
SCHEMBL17295694 0.76 PARP10 (0.53) KMT2AMEN1PARP10SMN1; SMN2PKM
SCHEMBL28799882 0.76 KMT2A (0.66) KMT2AMEN1PARP10SMN1; SMN2LMNA
SCHEMBL2633871 0.73 CES2 (0.59) KMT2AMEN1PARP10LMNARAB9A
SCHEMBL4185405 0.73 APP (0.37) SLC6A4
SCHEMBL9323737 0.73 LDHA (0.39) KMT2AMEN1LMNAHTTRAB9A
SCHEMBL4991362 0.72 ALDH1A3 (0.53) KMT2AMEN1SMN1; SMN2LMNAHPGD
SCHEMBL15514155 0.72 CHRNB2 (0.41) SMN1; SMN2ALDH1A1ESR1
SCHEMBL9323736 0.72 MAPT (0.41) KMT2AMEN1PARP10SMN1; SMN2LMNA

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-0409234-B1 Alpha-hydroxyketone derivatives, liquid crystal compositions containing said derivatives, and liquid crystal devices using said compositions CHISSO CORP (JP) 1994-02-16 EP disclosed
US-5164112-A Optical activity, ferroelectric, short response times CHISSO CORPORATION (JP) 1992-11-17 US disclosed
EP-0409234-A2 Alpha-hydroxyketone derivatives, liquid crystal compositions containing said derivatives, and liquid crystal devices using said compositions Chisso Corporation (JP) 1991-01-23 EP disclosed