SCHEMBL28583437

SCHEMBL28583437

O=C(O)c1cc(C(=O)O)c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 1/20 0.41
▸ KDM4B O94953 1/20 0.41
▸ KDM4D Q6B0I6 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ KMO O15229 1/20 0.41
▸ DHODH Q02127 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GPR35 Q9HC97 1/20 0.39
▸ HNF4A P41235 3/20 0.39
▸ ACMSD Q8TDX5 2/20 0.39
▸ CDC25B P30305 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ DHFR P00374 1/20 0.39
▸ MCL1 Q07820 1/20 0.39

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
SCHEMBL28588381 0.85 PTPN1 (0.49) KDM4EDHODHALDH1A1HPGDMAPT
SCHEMBL28289980 0.83 MAP2 (0.50) KDM4EDHODHALDH1A1HNF4ATP53
SCHEMBL28575871 0.82 KDM4E (0.49) KDM4EDHODHALDH1A1HPGDPIM1
SCHEMBL29082654 0.80 KMO (0.50) KDM4EKMODHODHALDH1A1MAPT
SCHEMBL28588384 0.78 ALDH1A1 (0.43) KDM4EDHODHALDH1A1HPGDMAPT
SCHEMBL28914795 0.78 CDC25B (0.48) KDM4EDHODHALDH1A1HPGDMAPT
SCHEMBL28288597 0.77 KDM4E (0.53) KDM4EDHODHALDH1A1HPGDMAPT
SCHEMBL28576792 0.77 MAPT (0.53) ALDH1A1HPGDMAPTTDP1LMNA
SCHEMBL6262453 0.74 HNF4A (0.50) KDM4EKMODHODHALDH1A1HNF4A
SCHEMBL28583832 0.73 GPR35 (0.47) KDM4EDHODHALDH1A1HPGDMAPT

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-109665958-B Method for preparing polysubstituted 1-naphthoic acid compound under catalysis of ruthenium 广州大学 2021-05-11 — — CN disclosed
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