SCHEMBL6058692

SCHEMBL6058692

CCCCCCCCCCC(C)C(OP(OC(c1ccc(C(C)(C)C)cc1C(C)(C)C)(c1ccc(C(C)(C)C)cc1C(C)(C)C)C(C)CCCCCCCCCC)OC(c1ccc(C(C)(C)C)cc1C(C)(C)C)(c1ccc(C(C)(C)C)cc1C(C)(C)C)C(C)CCCCCCCCCC)(c1ccc(C(C)(C)C)cc1C(C)(C)C)c1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.33
PRSS1 P07477 2/20 0.32
CTSG P08311 2/20 0.32
CTRB1 P17538 2/20 0.32
CMA1 P23946 2/20 0.32
PGR P06401 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
GAA P10253 1/20 0.30
XBP1 P17861 1/20 0.30
ATM Q13315 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL6058715 1.00 GHSR (0.33) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL9844473 1.00 GHSR (0.33) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL9844455 1.00 GHSR (0.33) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL6058548 1.00 GHSR (0.33) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL134529 1.00 GHSR (0.33) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL6704353 0.95 ATM (0.33) PGRRORARORCRORBGAA
SCHEMBL1081955 0.90 GHSR (0.33) GHSRPGRRORARORCRORB
SCHEMBL9844465 0.88 GHSR (0.34) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL9844561 0.88 GHSR (0.34) GHSRPRSS1CTSGCTRB1CMA1
SCHEMBL9844430 0.87 CNR1 (0.33) GAAXBP1ATMNPSR1L3MBTL1

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-7056963-B2 Polyester resin composition and process for the preparation thereof KANEKA CORPORATION (JP) 2006-06-06 US disclosed
EP-0416321-A1 Crystalline polyolefin composition Chisso Corporation (JP) 1991-03-13 EP disclosed