SCHEMBL24827509

SCHEMBL24827509

CC(C)c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CBS P35520 2/20 0.68
▸ CDK5 Q00535 2/20 0.68
▸ CDK5R1 Q15078 2/20 0.68
▸ PTPN1 P18031 2/20 0.68
▸ APP P05067 4/20 0.60
▸ ABCB1 P08183 3/20 0.58
▸ ESR1 P03372 2/20 0.58
▸ ESR2 Q92731 2/20 0.58
▸ PDE5A O76074 1/20 0.58
▸ PDE4D Q08499 1/20 0.58
▸ MAPT P10636 4/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ PKM P14618 3/20 0.56
▸ APEX1 P27695 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ POLB P06746 2/20 0.56
▸ RECQL P46063 2/20 0.56
▸ BLM P54132 2/20 0.56
▸ MCL1 Q07820 2/20 0.56

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
SCHEMBL17368660 0.90 CDK5 (0.54) CBSCDK5CDK5R1PTPN1APP
SCHEMBL29149138 0.89 ABCB1 (0.67) CBSCDK5CDK5R1PTPN1ABCB1
SCHEMBL14066713 0.82 CBS (0.74) CBSCDK5CDK5R1PTPN1APP
Cupressuflavone SCHEMBL505213 0.81 CBS (1.00) CBSCDK5CDK5R1PTPN1APP
Cupressuflavone SCHEMBL31670258 0.81 CBS (1.00) CBSCDK5CDK5R1PTPN1APP
SCHEMBL476215 0.81 CBS (0.78) CBSCDK5CDK5R1PTPN1APP
SCHEMBL29435853 0.81 CBS (0.78) CBSCDK5CDK5R1PTPN1APP
SCHEMBL28986431 0.81 CBS (0.78) CBSCDK5CDK5R1PTPN1APP
Cupressuflavone SCHEMBL4650575 0.80 CBS (0.97) CBSCDK5CDK5R1PTPN1APP
SCHEMBL12549094 0.78 PDE5A (0.72) CBSCDK5CDK5R1PTPN1APP

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-119930563-A Transient receptor potential cation channel TRPV3 inhibitor and application thereof 苏中药业集团股份有限公司 2025-05-06 — — CN disclosed
US-11540539-B2 Reduced sodium food products GENERAL MILLS, INC. (US) 2023-01-03 — — US disclosed
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