SCHEMBL28395686

SCHEMBL28395686

Cc1cc(O)c2c(c1)C(=O)c1c(O)c(O)cc(O)c1C2=O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 9/20 0.71
▸ PIM1 P11309 3/20 0.65
▸ MAPT P10636 5/20 0.64
▸ ALDH1A1 P00352 4/20 0.64
▸ MEN1 O00255 4/20 0.64
▸ KMT2A Q03164 4/20 0.64
▸ ELANE P08246 4/20 0.64
▸ CYP3A4 P08684 3/20 0.64
▸ MAPK1 P28482 3/20 0.64
▸ TDP1 Q9NUW8 3/20 0.64
▸ ALOX15 P16050 3/20 0.64
▸ TSHR P16473 2/20 0.64
▸ CYP1A1 P04798 2/20 0.64
▸ MAOA P21397 2/20 0.64
▸ MAOB P27338 2/20 0.64
▸ CYP1B1 Q16678 2/20 0.64
▸ HSD17B10 Q99714 2/20 0.64
▸ NPC1 O15118 1/20 0.64
▸ PTP4A3 O75365 1/20 0.64
▸ GMNN O75496 1/20 0.64

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
SCHEMBL30097984 1.00 ACLY (0.71) ACLYPIM1MAPTALDH1A1MEN1
Skyrin SCHEMBL2665352 0.89 ACLY (0.75) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL13570040 0.88 MAPT (0.72) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL29359680 0.85 MAPT (0.72) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL9170655 0.85 MAPT (0.72) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL12304029 0.85 ELANE (0.85) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL28421429 0.83 ACLY (0.69) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL30276368 0.83 ACLY (0.72) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL30276367 0.83 ACLY (0.69) ACLYPIM1MAPTALDH1A1MEN1
SCHEMBL28650629 0.83 ACLY (0.72) ACLYPIM1MAPTALDH1A1MEN1

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
CN-110981713-B Preparation method and application of 4-hydroxy emodin 沈阳药科大学 2022-09-23 — — CN disclosed
CN-110981713-A Preparation method and application of 4-hydroxy emodin 沈阳药科大学 2020-04-10 — — CN disclosed
Send feedback