SCHEMBL7647248

SCHEMBL7647248

Cc1ccc(OB(Oc2ccc(C)c3ccccc23)Oc2ccc(C)c3ccccc23)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.56
CYP2A6 P11509 3/20 0.44
ALDH1A1 P00352 3/20 0.38
IDO1 P14902 1/20 0.36
TSHR P16473 3/20 0.35
EP300 Q09472 1/20 0.35
KAT8 Q9H7Z6 1/20 0.35
HTT P42858 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
IMPDH2 P12268 1/20 0.33
IMPDH1 P20839 1/20 0.33
PKM P14618 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 3/20 0.32
ACHE P22303 1/20 0.32
GRIN2D O15399 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
SCHEMBL5224007 0.83 CYP1A2 (0.52) CYP1A2CYP2A6ALDH1A1IDO1TSHR
Tetrabuthylammonium SCHEMBL30595679 0.82 CYP1A2 (0.38) CYP1A2HTTMEN1KMT2AMAPK1
SCHEMBL637626 0.77 CYP1A2 (0.62) CYP1A2CYP2A6ALDH1A1IDO1EP300
SCHEMBL14950810 0.76 CYP1A2 (0.59) CYP1A2CYP2A6ALDH1A1IDO1TSHR
SCHEMBL29447796 0.75 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRHTT
SCHEMBL29363045 0.75 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRHTT
SCHEMBL161370 0.75 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRHTT
Hydrochloric Acid SCHEMBL1134109 0.74 EP300 (0.59) CYP1A2CYP2A6ALDH1A1IDO1EP300
SCHEMBL904667 0.74 CYP1A2 (0.56) CYP1A2CYP2A6ALDH1A1IDO1TSHR
SCHEMBL26022648 0.74 HTT (0.62) CYP1A2ALDH1A1TSHRHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829989-A Photocurable composition, cured product thereof, and optical material containing the cured product 三菱瓦斯化学株式会社 2023-09-29 CN disclosed
CN-116149137-A Curable resin composition and cured film 住友化学株式会社 2023-05-23 CN disclosed
US-6486225-B1 Photocurable composition SHOWA DENKO KABUSHIKI KAISHA (JP) 2002-11-26 US disclosed
US-20010046643-A1 Stabilizer for organic borate salts and photosensitive composition containing the same OGATA TOMONARI (JP) 2001-11-29 US disclosed