SCHEMBL30942596

SCHEMBL30942596

CCC(CC)CCCc1ccccc1C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ CYP19A1 P11511 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ MAPT P10636 4/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ HPGD P15428 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ SLC16A3 O15427 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ AGTR1 P30556 1/20 0.38

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
SCHEMBL6684004 0.85 ALDH1A1 (0.47) CDC25BATMCYP19A1SMN1; SMN2MAPT
SCHEMBL30516309 0.80 CDC25B (0.62) CDC25BATMCYP19A1SMN1; SMN2MAPT
SCHEMBL17272972 0.77 ALDH1A1 (0.46) ALDH1A1CA2CYP3A4PRSS1PRSS2
SCHEMBL489479 0.77 CDC25B (0.47) CDC25BATMCYP19A1SMN1; SMN2L3MBTL1
SCHEMBL11658107 0.77 GRIN2D (0.48) CDC25BATMSLC16A3KDM4E
SCHEMBL2490283 0.76 CDC25B (0.45) CDC25BATMSMN1; SMN2MAPTL3MBTL1
SCHEMBL30405946 0.76 ALDH1A1 (0.51) CYP19A1MAPTL3MBTL1CNR2ALDH1A1
SCHEMBL7164776 0.75 AKR1C3 (0.48) CYP19A1MAPTL3MBTL1CNR2ALDH1A1
SCHEMBL30431499 0.75 ALDH1A1 (0.42) CDC25BATMCNR1CNR2ALDH1A1
SCHEMBL489478 0.74 ALDH1A1 (0.74) CDC25BATML3MBTL1CNR1CNR2

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
WO-2024135300-A1 COSMETIC COMPOSITION, COSMETIC COMPOSITION FOR SUPPRESSING DISCOLORATION, AND DISCOLORATION SUPPRESSANT 株式会社資生堂 2024-06-27 — — WO disclosed
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