SCHEMBL30320269

SCHEMBL30320269

Cc1cc(CC(c2ccc(C(C)(C)c3ccc(O)c(C)c3)cc2)c2ccc(O)c(C)c2)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 13/20 0.56
ESR2 Q92731 8/20 0.44
AR P10275 4/20 0.41
RORC P51449 1/20 0.40
KLF10 Q13118 1/20 0.40
ESRRG P62508 1/20 0.39
NR3C1 P04150 2/20 0.36
PGR P06401 2/20 0.36
NR3C2 P08235 1/20 0.36
CNR1 P21554 2/20 0.35
CNR2 P34972 1/20 0.35
ALOX15 P16050 4/20 0.35
ALOX12 P18054 4/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
HPGD P15428 2/20 0.35
MAPK1 P28482 2/20 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
SCHEMBL30375009 0.93 ESR1 (0.48) ESR1ESR2ARRORCKLF10
SCHEMBL1405931 0.87 ESR1 (0.57) ESR1ESR2ARNR3C1PGR
SCHEMBL4025450 0.84 ESR1 (0.50) ESR1ESR2ARNR3C1PGR
SCHEMBL2561070 0.84 ESR1 (0.50) ESR1ESR2ARNR3C1PGR
Bisphenol A SCHEMBL7115738 0.84 ESR1 (0.49) ESR1ESR2ARRORCESRRG
SCHEMBL30374574 0.81 RORC (0.38) ESR1ESR2ARRORCKLF10
SCHEMBL30375004 0.81 SHBG (0.40) ESR1ESR2ARRORCKLF10
SCHEMBL30374779 0.81 ALOX15 (0.52) ESR1ESR2ARRORCKLF10
SCHEMBL30374761 0.81 CA2 (0.40) ESR1ESR2RORCKLF10NR3C1
SCHEMBL8357018 0.81 ESR1 (0.53) ESR1ESR2ARNR3C1PGR

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
CN-119709173-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment having the same encapsulated therein 百乐墨水株式会社 2025-03-28 CN disclosed
CN-119242290-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment having the same encapsulated therein 百乐墨水株式会社 2025-01-03 CN disclosed
CN-116209725-B Reversible thermochromic composition and reversible thermochromic microcapsule pigment having the same encapsulated therein 百乐墨水株式会社 2024-12-31 CN disclosed
CN-113646052-B Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument 百乐墨水株式会社 2024-05-17 CN disclosed
CN-116209725-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment having the same encapsulated therein 百乐墨水株式会社 2023-06-02 CN disclosed
CN-116113548-A Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing same 百乐墨水株式会社 2023-05-12 CN disclosed
CN-113785023-B Water-based ink composition for reversible thermochromic writing instrument, refill for refill and water-based ballpoint pen incorporating same 株式会社百乐 2023-05-12 CN disclosed