SCHEMBL13409834

SCHEMBL13409834

COC(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)Oc3ccc(C4(c5ccc(C)cc5)CCCCC4)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ ESR1 P03372 2/20 0.35
▸ ESR2 Q92731 2/20 0.35
▸ PPARA Q07869 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33

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
SCHEMBL2743135 0.90 ADORA3 (0.46) ADORA3KDM4EHPGDSLC6A2SLC6A4
SCHEMBL16775316 0.88 ADORA3 (0.48) ADORA3SLC6A2MAPTHTTSMN1; SMN2
SCHEMBL16405351 0.86 ADORA3 (0.49) ADORA3SLC6A2MAPTHTTSMN1; SMN2
SCHEMBL15336467 0.84 ADORA3 (0.50) ADORA3KDM4EHPGDSLC6A4SLC6A3
SCHEMBL14877709 0.83 KDM4E (0.47) ADORA3KDM4EHPGDSLC6A4SLC6A3
SCHEMBL12021704 0.83 MAPT (0.47) ADORA3KDM4EHPGDSLC6A2SLC6A4
SCHEMBL410353 0.83 LMNA (0.48) MAPTNPC1RAB9ALMNAMMP13
SCHEMBL13346992 0.83 PPARA (0.45) ADORA3MAPTHTTSMN1; SMN2NPC1
SCHEMBL17298988 0.82 ADORA3 (0.52) ADORA3MAPTHTTSMN1; SMN2NPC1
SCHEMBL16158988 0.81 ADORA3 (0.43) ADORA3KDM4EHPGDSLC6A4SLC6A3

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
US-7700696-B2 Polycarbonate composition having improved scratch resistance, and articles formed therefrom SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-04-20 — — US disclosed
US-20080004404-A1 THERMOPLASTIC COMPOSITION HAVING IMPROVED SCRATCH RESISTANCE, AND ARTICLES FORMED THEREFROM GENERAL ELECTRIC COMPANY (US) 2008-01-03 — — US disclosed
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