SCHEMBL4599993

SCHEMBL4599993

C(=C(c1ccccc1)c1ccccc1)c1c2ccccc2c(C=C(c2ccccc2)c2ccccc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.48
CYP11B2 P19099 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
PTGS2 P35354 4/20 0.46
ESR1 P03372 1/20 0.45
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PADI4 Q9UM07 1/20 0.37
DAO P14920 1/20 0.36
TSHR P16473 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
MAPK1 P28482 1/20 0.36
AKR1C1 Q04828 1/20 0.35

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
SCHEMBL6304315 0.88 ESR1 (0.41) CYP19A1CYP11B2TDP1PTGS2ESR1
SCHEMBL6304314 0.88 ESR1 (0.41) CYP19A1CYP11B2TDP1PTGS2ESR1
SCHEMBL1075458 0.87 ESR1 (0.44) CYP19A1CYP11B2TDP1ESR1ALDH1A1
SCHEMBL6297768 0.83 C1S (0.42) CYP19A1CYP11B2PTGS2ALDH1A1
SCHEMBL6297766 0.83 C1S (0.42) CYP19A1CYP11B2PTGS2ALDH1A1
SCHEMBL8050557 0.82 PTGS2 (0.50) TDP1PTGS2ESR1ALDH1A1CYP1A2
SCHEMBL13992020 0.82 ALDH1A1 (0.41) CYP19A1CYP11B2TDP1PTGS2ESR1
SCHEMBL10841601 0.78 PTGS2 (0.48) CYP19A1CYP11B2TDP1PTGS2ESR1
SCHEMBL2210237 0.78 ALDH1A1 (0.34) CYP19A1CYP11B2TDP1PTGS2ESR1
SCHEMBL6297970 0.78 PTGS2 (0.40) CYP19A1CYP11B2TDP1PTGS2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111916567-A White light lighting equipment with high color rendering index 莱芜职业技术学院 2020-11-10 CN disclosed
EP-1914741-A2 Optical pickup apparatus and optical reproducing method Funai Electric Co., Ltd. (JP) 2008-04-23 EP disclosed
EP-1912209-A1 Optical recording medium, recording method of information on optical recording medium and reproducing method thereof Funai Electric Co., Ltd. (JP) 2008-04-16 EP disclosed
US-20080084806-A1 Optical recording medium, recording method of information on optical recording medium and reproducing method thereof FUNAI ELECTRIC CO., LTD. (JP) 2008-04-10 US disclosed
US-20080084801-A1 Optical pickup apparatus and optical reproducing method FUNAI ELECTRIC CO., LTD. (JP) 2008-04-10 US disclosed