SCHEMBL7220363

SCHEMBL7220363

CCCCCC(=O)c1ccc2c(c1)C1(c3ccccc3-2)c2ccccc2-c2ccc(C(=O)CCCCC)cc21

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HSD17B3 P37058 7/20 0.49
▸ PDK2 Q15119 7/20 0.46
▸ KDM4E B2RXH2 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HTR7 P34969 1/20 0.42
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41

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
SCHEMBL7214386 0.85 HSD17B3 (0.48) HSD17B3HTR7
SCHEMBL28228004 0.84 HSD17B3 (0.47) HSD17B3PDK2KDM4EL3MBTL1CES2
SCHEMBL28228075 0.84 HSD17B3 (0.47) HSD17B3PDK2KDM4EL3MBTL1CES2
SCHEMBL21974968 0.79 PDK2 (0.39) HSD17B3PDK2CES2CES1
SCHEMBL23805907 0.78 APEX1 (0.47) HSD17B3PDK2L3MBTL1HTR7
SCHEMBL15159198 0.78 PDK2 (0.42) PDK2
SCHEMBL15131513 0.78 PDK2 (0.44) PDK2L3MBTL1
SCHEMBL9597813 0.78 KDM4E (0.64) HSD17B3KDM4EL3MBTL1HTR7
SCHEMBL21974941 0.77 PDK2 (0.41) PDK2
Methyl Alcohol SCHEMBL28550227 0.77 KDM4E (0.62) HSD17B3KDM4EL3MBTL1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6559277-B2 Soluble poly(bis-9,9'-fluorenes) comprise identical or different structural repeating units of the formula I, admixture with at least one additional fluorophore whose absorption band overlaps the emission band (fluorescent VANTICO INC. 2003-05-06 — — US disclosed
US-20020132911-A1 Poly(9,9'-Spirobisfluorenes), their production and their use VANTICO INC. AND VANTICO A&T U S INC. (NOW KNOWN AS HUNTSMAN ADVANCED MATERIALS AMERICAS INC.) 2002-09-19 — — US disclosed
US-6380445-B1 AROMATIC RESINS VANTICO INC. 2002-04-30 — — US disclosed
US-6132641-A SOLVENT AND POLYMER OF POLY(BIS-9,9'-FLUORENE) AND FLUORESCENT DYE VANTICO, INC. (US) 2000-10-17 — — US disclosed
EP-0863931-A2 POLY(9,9'-SPIRO-BISFLUORENES), THE PRODUCTION AND USE OF SAME Ciba SC Holding AG (CH) 1998-09-16 — — EP disclosed
WO-1997020877-A2 POLY(9,9'-SPIRO-BISFLUORENES), THE PRODUCTION AND USE OF SAME CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-06-12 — — WO disclosed
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