SCHEMBL27410860

SCHEMBL27410860

O=C(COc1ccc(Cl)cc1)OC(=O)COc1ccc(Cl)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.62
▸ ALDH1A1 P00352 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ TSHR P16473 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ HTT P42858 1/20 0.52
▸ MAPT P10636 6/20 0.51
▸ GAA P10253 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALOX12 P18054 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ LMNA P02545 1/20 0.50

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
SCHEMBL27374984 0.86 TDP1 (0.64) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL3913180 0.85 PTGS2 (0.60) ALDH1A1L3MBTL1SMN1; SMN2MAPTHPGD
SCHEMBL27890385 0.84 PTGS2 (0.58) ALDH1A1L3MBTL1SMN1; SMN2MAPTHPGD
SCHEMBL11655261 0.83 TDP1 (0.64) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL14959826 0.83 TDP1 (0.64) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
Chlorobenzene SCHEMBL27814509 0.82 TDP1 (0.58) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL28372328 0.82 TDP1 (0.62) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL27374559 0.81 TDP1 (0.71) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL14361927 0.81 TDP1 (0.70) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL6098184 0.80 TDP1 (0.55) TDP1ALDH1A1L3MBTL1TSHRMAPT

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
CN-1095887-A Watermelon removes seed, swelling agent and manufacturing thereof, using method XU XIAOYAN (CN) 1994-12-07 — — CN claimed
Send feedback