SCHEMBL19478231

SCHEMBL19478231

COc1c(O)c(OC)c2c(c1OC)C(=O)c1ccccc1C2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.56
▸ MEN1 O00255 6/20 0.56
▸ KMT2A Q03164 6/20 0.56
▸ RAB9A P51151 4/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ ALDH1A1 P00352 7/20 0.55
▸ KDM4E B2RXH2 5/20 0.55
▸ TDP1 Q9NUW8 4/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ HPGD P15428 4/20 0.55
▸ CYP3A4 P08684 3/20 0.55
▸ ALOX15 P16050 3/20 0.55
▸ POLB P06746 3/20 0.55
▸ CDC25A P30304 2/20 0.55
▸ CDC25B P30305 2/20 0.55
▸ LMNA P02545 2/20 0.55
▸ MAP2K7 O14733 1/20 0.55
▸ GMNN O75496 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55

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
SCHEMBL28656542 0.91 PDE4A (0.55) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL11691658 0.86 MAPT (0.63) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL8341400 0.80 MAPT (0.69) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL19461410 0.79 MAPT (0.61) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL17492955 0.78 PIM1 (0.48) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL18601894 0.78 RAB9A (0.62) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL6361693 0.78 EPHX2 (0.67) MAPTMEN1KMT2ARAB9ANPC1
Hydrochloric Acid SCHEMBL1488003 0.77 PIM1 (0.47) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL1149730 0.77 MAPT (0.66) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL29906115 0.76 SMN1; SMN2 (0.70) MAPTMEN1KMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3445382-B1 HARUNGANA MADAGASCARIENSIS LEAF EXTRACT FOR USE IN THE TREATMENT AND/OR PREVENTION OF ACNE SOCIÉTÉ D'EXPLOITATION DE PRODUITS POUR LES IND CHIMIQUES SEPPIC (FR) 2020-09-09 — — EP disclosed
CN-109069563-A For treating and/or preventing Madagascar's Ha Lunjiana leaf extract of acne 化工产品开发公司SEPPIC 2018-12-21 — — CN disclosed
WO-2017182182-A1 HARUNGANA MADAGASCARIENSIS LEAF EXTRACT FOR USE IN THE TREATMENT AND/OR PREVENTION OF ACNE SOCIETE D'EXPLOITATION DE PRODUITS POUR LES INDUSTRIES CHIMIQUES SEPPIC (FR) 2017-10-26 — — WO disclosed
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