SCHEMBL7033161

SCHEMBL7033161

CCOc1ccc(P(=O)(C(=O)c2c(C)cc(C)cc2C)C(=O)c2c(C)cc(C)cc2C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
PLK1 P53350 1/20 0.42
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MMP1 P03956 1/20 0.41
MMP13 P45452 1/20 0.41
ADAM17 P78536 1/20 0.41
PARP10 Q53GL7 1/20 0.41
NQO1 P15559 1/20 0.40
ITGB1 P05556 1/20 0.40

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
SCHEMBL7641139 0.84 ALDH1A1 (0.43) PLK1ALDH1A1GAAMAPTNPC1
SCHEMBL444581 0.81 LMNA (0.45) ALDH1A1GAASMN1; SMN2MEN1LMNA
SCHEMBL7175426 0.80 GLA (0.41) ALDH1A1MAPTRAB9APOLBMEN1
SCHEMBL6428969 0.79 PLK1 (0.41) PLK1ALDH1A1GAAMAPTNPC1
SCHEMBL17853885 0.78 KMT2A (0.38) GAAMAPTSMN1; SMN2ITGB1ITGA4
SCHEMBL30038269 0.77 FLT1 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL58953 0.77 TAS1R3 (0.46) PLK1ALDH1A1MAPTNPC1RAB9A
SCHEMBL15158 0.77 LMNA (0.40) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL57936 0.77 IDO1 (0.50) ALDH1A1MAPTNPC1RAB9APOLB
SCHEMBL7179536 0.77 PTGER1 (0.42) ALDH1A1GAAMAPTNPC1RAB9A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826692-B1 Molecular complexes as photoinitiators CIBA SC HOLDING AG (CH) 2003-03-05 EP claimed
US-5942290-A MOLECULAR COMPLEX OF A MONO-, BIS- OR TRIACYLPHOSPHINE OXIDE ASSOCIATED WITH AN ALPHA-HYDROXY KETONE IN CRYSTALLINE FORM BY WAY OF HYDROGEN BONDING; PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-24 US claimed
CN-112154167-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-12-29 CN disclosed
US-20200290267-A1 Three-Dimensional Printing of Impregnated Plastics for Chemical Reactions UCL BUSINESS PLC (GB) 2020-09-17 US disclosed
CN-111315828-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-06-19 CN disclosed
EP-3430473-A1 THREE-DIMENSIONAL PRINTING OF IMPREGNATED PLASTICS FOR CHEMICAL REACTIONS UCL Business Plc. (GB) 2019-01-23 EP disclosed
US-5942290-A MOLECULAR COMPLEX OF A MONO-, BIS- OR TRIACYLPHOSPHINE OXIDE ASSOCIATED WITH AN ALPHA-HYDROXY KETONE IN CRYSTALLINE FORM BY WAY OF HYDROGEN BONDING; PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-24 US disclosed