SCHEMBL7971353

SCHEMBL7971353

O=C(Oc1ccccc1)C(Cl)CCCCCl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.41
ATM Q13315 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALOX15 P16050 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ELANE P08246 1/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
MEN1 O00255 1/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
KMT2A Q03164 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL7976235 0.95 TDP1 (0.42) TDP1ATML3MBTL1ALOX15SMN1; SMN2
SCHEMBL7062943 0.88 ATM (0.44) TDP1ATML3MBTL1ALOX15ELANE
SCHEMBL8425998 0.84 TDP1 (0.44) TDP1ATML3MBTL1SMN1; SMN2ELANE
SCHEMBL10877734 0.83 ZDHHC2 (0.46) TDP1PRSS1PRSS2PRSS3SIRT1
SCHEMBL12266041 0.82 METAP2 (0.49) TDP1ATML3MBTL1SMN1; SMN2PPARG
SCHEMBL10399716 0.81 ATM (0.46) TDP1ATML3MBTL1ALOX15SMN1; SMN2
SCHEMBL7973137 0.79 ALDH1A1 (0.50) TDP1L3MBTL1ELANESIRT1KMT2A
SCHEMBL7971288 0.77 HCAR2 (0.48) TDP1L3MBTL1SMN1; SMN2PPARGNPC1
SCHEMBL6305898 0.77 ATM (0.52) TDP1ATML3MBTL1ALOX15ELANE
SCHEMBL11230296 0.76 GAA (0.44) TDP1L3MBTL1SMN1; SMN2MAPTMEN1

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
US-6172234-B1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-09 US disclosed
EP-0976729-A1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed