SCHEMBL1897895

SCHEMBL1897895

CC(C)(C)c1ccc(-c2ccc(OPOc3ccc(-c4ccc(C(C)(C)C)cc4C(C)(C)C)c(-c4ccccc4)c3)cc2-c2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 1/20 0.36
PLA2G1B P04054 1/20 0.36
NFKB1 P19838 1/20 0.36
CASP3 P42574 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 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
SCHEMBL27998068 0.83 RAB9A (0.38) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL1898408 0.83 SHMT1 (0.35) NPC1RAB9AL3MBTL1NPSR1LMNA
SCHEMBL27737001 0.81 ALDH1A1 (0.49) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL29798917 0.81 ALDH1A1 (0.49) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL2001067 0.81 NPC1 (0.34) NPC1RAB9AL3MBTL1ALDH1A1NFKB1
SCHEMBL28233022 0.80 NPC1 (0.41) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL500633 0.77 GPR84 (0.35) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL29496598 0.77 NPC1 (0.40) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL30524348 0.76 NPC1 (0.46) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B
SCHEMBL7067289 0.76 NPC1 (0.46) NPC1RAB9AL3MBTL1ALDH1A1PLA2G1B

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-8969436-B2 Method of producing a molded article TEIJIN CHEMICALS, LTD. (JP) 2015-03-03 US claimed
US-20110147992-A1 METHOD OF PRODUCING A MOLDED ARTICLE TEIJIN CHEMICALS, LTD. (JP) 2011-06-23 US claimed
EP-2319887-A1 METHOD FOR MANUFACTURING MOLDED ARTICLE Teijin Chemicals, Ltd. (JP) 2011-05-11 EP claimed
US-8969436-B2 Method of producing a molded article TEIJIN CHEMICALS, LTD. (JP) 2015-03-03 US disclosed
US-20110147992-A1 METHOD OF PRODUCING A MOLDED ARTICLE TEIJIN CHEMICALS, LTD. (JP) 2011-06-23 US disclosed
EP-2319887-A1 METHOD FOR MANUFACTURING MOLDED ARTICLE Teijin Chemicals, Ltd. (JP) 2011-05-11 EP disclosed