SCHEMBL9933563

SCHEMBL9933563

CC(C)c1[c]ccc(-c2ccccc2)c1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
METAP2 P50579 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL7808712 0.84 LDHA (0.35)
SCHEMBL16150176 0.81 GCGR (0.34) CDC25ACDC25BMETAP2ADORA3ADORA2A
SCHEMBL11392952 0.79 CA1 (0.35)
SCHEMBL4959521 0.79 PTGS2 (0.32)
SCHEMBL2160199 0.77 CDC25A (0.38) CDC25ACDC25BMETAP2ADORA3ADORA2A
SCHEMBL6838848 0.75 CDC25A (0.41) CDC25ACDC25BMETAP2ADORA3ADORA2A
SCHEMBL1072425 0.75 MYC (0.32)
SCHEMBL18935678 0.75 GABRA1 (0.35)
SCHEMBL14157332 0.75 GABRA1 (0.35)
SCHEMBL28423706 0.73 CDC25A (0.44) CDC25ACDC25BBACE1

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-9217073-B2 Transparent and flame retarding polyester resin composition and preparation method thereof SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-22 US disclosed
US-20120157607-A1 TRANSPARENT AND FLAME RETARDING POLYESTER RESIN COMPOSITION AND PREPARATION METHOD THEREOF SHINIL CHEMICAL INDUSTRY CO., LTD. (KR) 2012-06-21 US disclosed