SCHEMBL9355491

SCHEMBL9355491

O=C(O)CC(C(=O)O)=C(Cc1ccc(Cl)cc1Cl)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ ERCC1 P07992 3/20 0.45
▸ ERCC4 Q92889 3/20 0.45
▸ P2RX7 Q99572 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ GALR3 O60755 1/20 0.44
▸ NR2F2 P24468 1/20 0.44
▸ ERCC5 P28715 1/20 0.43
▸ FEN1 P39748 1/20 0.43
▸ RECQL P46063 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42

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
SCHEMBL9355183 0.81 CTBP2 (0.53) ALDH1A1
SCHEMBL11311719 0.80 ALDH1A1 (0.50) ALDH1A1ERCC1ERCC4P2RX7HPGD
SCHEMBL29419329 0.79 CHRM1 (0.57) ALDH1A1ERCC1ERCC4P2RX7TP53
SCHEMBL260512 0.79 CHRM1 (0.57) ALDH1A1ERCC1ERCC4P2RX7TP53
Hydrochloric Acid SCHEMBL2532568 0.78 CHRM1 (0.55) ALDH1A1ERCC1ERCC4P2RX7HPGD
SCHEMBL9358528 0.74 ERCC5 (0.57) ALDH1A1HPGDERCC5FEN1RECQL
SCHEMBL28940593 0.74 IDO1 (0.54) ERCC1ERCC4P2RX7GALR3NR2F2
SCHEMBL8467565 0.73 TP53 (0.46) ERCC1ERCC4P2RX7HPGDGALR3
SCHEMBL8744740 0.73 ERCC1 (0.59) ALDH1A1ERCC1ERCC4P2RX7HPGD
SCHEMBL11217809 0.72 PGK1 (0.48) ALDH1A1ERCC1ERCC4P2RX7HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0242618-B1 Transparent optical article and process for preparing same NIPPON OILS & FATS CO LTD (JP) 1994-11-02 — — EP claimed
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