SCHEMBL29384142

SCHEMBL29384142

O=c1cc(-c2cccc(O)c2)oc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 5/20 1.00
PARP1 P09874 4/20 1.00
TNKS2 Q9H2K2 4/20 1.00
CYP3A4 P08684 5/20 0.78
HPGD P15428 4/20 0.78
SMN1; SMN2 Q16637 4/20 0.78
MAPT P10636 4/20 0.78
ALDH1A1 P00352 3/20 0.78
TP53 P04637 2/20 0.78
MEN1 O00255 1/20 0.78
CYP2C9 P11712 1/20 0.78
KMT2A Q03164 1/20 0.78
GLA P06280 1/20 0.78
NPC1 O15118 3/20 0.72
RAB9A P51151 3/20 0.72
KDM4E B2RXH2 2/20 0.72
BCHE P06276 1/20 0.72
POLB P06746 1/20 0.72
ACHE P22303 1/20 0.72
TDP1 Q9NUW8 1/20 0.72

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
SCHEMBL29677954 1.00 TNKS (1.00) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL311580 1.00 TNKS (1.00) TNKSPARP1TNKS2CYP3A4HPGD
Flavone SCHEMBL27534477 0.89 TNKS (0.85) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL4277649 0.88 MAPT (1.00) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL3135989 0.88 CYP3A4 (1.00) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL31675776 0.88 CYP3A4 (1.00) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL1483977 0.87 TNKS (0.77) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL29773081 0.84 TNKS (1.00) TNKSPARP1TNKS2CYP3A4HPGD
SCHEMBL127446 0.84 TNKS (1.00) TNKSPARP1TNKS2CYP3A4HPGD
Flavone SCHEMBL15676601 0.83 TNKS (1.00) TNKSPARP1TNKS2CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263774-A1 DISCOVERING NEW XENOBIOTIC SUBSTRATES OF AN UDP-GLYCOSYLTRANSFERASE WITH A HIGH-THROUGHPUT METHOD UNIV NORTH TEXAS (US) 2025-08-21 US disclosed
CN-118001403-A Method for preparing phosphoric acid nano-drug based on competitive coordination and multifunctional nano-drug 吉林大学 2024-05-10 CN disclosed
CN-114014905-B Glycyrrhetinic acid derivative targeting PPARgamma as well as preparation method and application thereof 浙江科技学院 2023-07-21 CN disclosed
CN-110551169-B Glycyrrhetinic acid derivative and preparation method and application thereof 陈昱西 2022-07-15 CN disclosed
CN-114014905-A PPAR gamma targeted glycyrrhetinic acid derivative and preparation method and application thereof 浙江科技学院 2022-02-08 CN disclosed