SCHEMBL27587077

SCHEMBL27587077

CC(=O)OC(=O)c1ccccc1C(=O)O.[H+]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ KDM4E B2RXH2 4/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ TSHR P16473 2/20 0.53
▸ HMGB1 P09429 2/20 0.53
▸ NAPRT Q6XQN6 2/20 0.53
▸ ESR1 P03372 1/20 0.53
▸ ITGB3 P05106 1/20 0.53
▸ ITGA2B P08514 1/20 0.53
▸ GGT1 P19440 1/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ PTGS2 P35354 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ LMNA P02545 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CA12 O43570 3/20 0.46

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
Phthalic Acid SCHEMBL27618505 0.98 ALDH1A1 (0.58) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL154741 0.98 ALDH1A1 (0.58) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL27748399 0.96 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL27774451 0.96 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL28533754 0.96 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHSD17B10HPGD
Acetic Acid SCHEMBL28815277 0.96 ALDH1A1 (0.56) ALDH1A1ALOX15KDM4EHSD17B10HPGD
Acetic Acid SCHEMBL28536661 0.90 TSHR (0.48) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL30084385 0.89 TSHR (0.52) ALDH1A1ALOX15KDM4EHSD17B10HPGD
SCHEMBL2778 0.89 TSHR (0.52) ALDH1A1ALOX15KDM4EHSD17B10HPGD
Succinic Acid SCHEMBL28992466 0.89 ALDH1A1 (0.49) ALDH1A1ALOX15KDM4EHSD17B10HPGD

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-1531418-A Manufacturing dissolvable dosage forms ���ض������о�Ժ 2004-09-22 — — CN disclosed
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