SCHEMBL28977532

SCHEMBL28977532

CCCCCCCCOP(O)Oc1ccccc1CCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
LIPG Q9Y5X9 1/20 0.43
LTB4R Q15722 1/20 0.43
LTB4R2 Q9NPC1 1/20 0.43
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
PPARA Q07869 2/20 0.41
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
NR1I2 O75469 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
MAPT P10636 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC6 Q9UBN7 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
SCHEMBL22749527 1.00 THRA (0.49) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL28191406 0.97 THRA (0.52) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL31278477 0.87 THRA (0.49) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL1487512 0.87 THRA (0.49) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL28376630 0.86 THRA (0.58) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL29778064 0.86 THRA (0.58) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL317708 0.86 THRA (0.58) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL8433693 0.86 THRA (0.58) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL8372832 0.86 THRA (0.58) THRATHRBLIPGLTB4RLTB4R2
SCHEMBL9294713 0.85 LTB4R (0.48) THRATHRBLIPGLTB4RLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115867611-A Polyorganosiloxane-containing polymer particles, composition, resin composition, and molded article 三菱化学株式会社 2023-03-28 CN disclosed