SCHEMBL3836026

SCHEMBL3836026

CC(C)(O)c1ccc(C(C)(C)O)c(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.40
BACE1 P56817 2/20 0.39
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
ESR2 Q92731 3/20 0.35
PGR P06401 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
ESR1 P03372 2/20 0.34
ALDH1A1 P00352 2/20 0.34
ALOX5 P09917 1/20 0.34
CYP3A4 P08684 1/20 0.34
NPC1 O15118 1/20 0.34
PLA2G1B P04054 1/20 0.34
NFKB1 P19838 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL16585739 0.80 PTGDR2 (0.43) BACE1ESR2PGRPTGDR2ALDH1A1
SCHEMBL547913 0.78 ALDH1A1 (0.44) CYP2C9BACE1ESR2ALDH1A1CYP3A4
SCHEMBL1338711 0.77 TRPV1 (0.41) CYP2C9NPC1RAB9ATNKSPARP1
SCHEMBL5552881 0.77 ALDH1A1 (0.48) BACE1ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL4509959 0.76 CYP2C9 (0.45) CYP2C9BACE1ESR2ESR1ALDH1A1
SCHEMBL14063307 0.76 PTGS2 (0.43) CYP2C9BACE1ESR2PGRALDH1A1
SCHEMBL27736916 0.74 NPC1 (0.46) CYP2C9ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL548369 0.73 MEN1 (0.36) ESR2PGRESR1ALDH1A1CYP3A4
SCHEMBL429422 0.73 CYP2C9 (0.56) CYP2C9ESR2ESR1ALDH1A1CYP3A4
SCHEMBL4506291 0.73 CYP2C9 (0.56) CYP2C9ESR2ESR1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023089976-A1 CURABLE RESIN, CURABLE RESIN COMPOSITION, AND CURED OBJECT DIC株式会社 2023-05-25 WO disclosed
US-20230159695-A1 CURABLE RESIN, CURABLE RESIN COMPOSITION, AND CURED PRODUCT DIC CORPORATION (JP) 2023-05-25 US disclosed
WO-2023008079-A1 CURABLE RESIN COMPOSITION AND CURED PRODUCT DIC株式会社 2023-02-02 WO disclosed
EP-1285027-B2 BRANCHED CARBONATE POLYMER COMPOSITION DOW GLOBAL TECHNOLOGIES INC (US) 2009-09-30 EP disclosed
EP-1285027-B1 BRANCHED CARBONATE POLYMER COMPOSITION DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-29 EP disclosed
US-5399715-A Polyamino oligomers and polymaleimide compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-21 US disclosed
EP-0577836-A1 POLYAMINO-OLIGOMER AND POLYMALEIMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-01-12 EP disclosed
US-5001177-A Branched thermoplastic polycarbonates having improved protection against UV light BAYER AKTIENGESELLSCHAFT (DE) 1991-03-19 US disclosed