SCHEMBL5645939

SCHEMBL5645939

COC(=O)c1cc2c3c(ccc2cc1OC(C)=O)OC(/C(C)=C/c1ccccc1)(c1ccc(OC)cc1)C=C3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.35
KMT2A Q03164 4/20 0.33
RAB9A P51151 4/20 0.33
MEN1 O00255 3/20 0.33
NPC1 O15118 3/20 0.33
PLA2G2A P14555 2/20 0.33
HSP90AA1 P07900 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32
TUBA3E Q6PEY2 1/20 0.32
TUBA1A Q71U36 1/20 0.32
TUBA1C Q9BQE3 1/20 0.32

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
SCHEMBL5645944 1.00 ACHE (0.35) ACHEKMT2ARAB9AMEN1NPC1
SCHEMBL8522688 0.81 MAPT (0.34) ACHEKMT2ARAB9AMEN1NPC1
SCHEMBL1387238 0.77 HIF1A (0.34) ACHEKMT2ARAB9AMEN1NPC1
SCHEMBL9000591 0.76 PTGS1 (0.34) ACHE
SCHEMBL9000584 0.76 PTGS1 (0.34) ACHE
SCHEMBL1387468 0.72 HIF1A (0.36) ACHEKMT2AMEN1NPC1PLA2G2A
SCHEMBL8667535 0.72 HTT (0.42) KMT2AMEN1NPC1ALDH1A1KDM4E
SCHEMBL8667533 0.72 HTT (0.42) KMT2AMEN1NPC1ALDH1A1KDM4E
SCHEMBL1333813 0.69 HIF1A (0.34) ACHEPLA2G2AHSP90AA1ALDH1A1KDM4E
SCHEMBL1387201 0.69 POLB (0.40) KMT2AMEN1HSP90AA1ALDH1A1KDM4E

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-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US claimed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US claimed
US-5578252-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1996-11-26 US claimed
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US disclosed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US disclosed
US-5578252-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1996-11-26 US disclosed