SCHEMBL29062045

SCHEMBL29062045

CCCCCCc1csc(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 5/20 0.41
ACHE P22303 2/20 0.38
LIPG Q9Y5X9 1/20 0.38
BACE1 P56817 1/20 0.38
ALOX5 P09917 4/20 0.37
TYR P14679 2/20 0.37
TP53 P04637 2/20 0.37
CYP3A4 P08684 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYSLTR2 Q9NS75 2/20 0.35
CYSLTR1 Q9Y271 2/20 0.35
PTGS2 P35354 4/20 0.33
ESR1 P03372 2/20 0.33
ADRA2A P08913 2/20 0.33

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
SCHEMBL5282461 0.85 GPR35 (0.41) GPR35ACHELIPGBACE1ALOX5
SCHEMBL27825706 0.83 GPR35 (0.44) GPR35ACHELIPGBACE1ALOX5
SCHEMBL27659633 0.83 GPR35 (0.44) GPR35ACHELIPGBACE1ALOX5
SCHEMBL13429481 0.83 GPR35 (0.44) GPR35ACHELIPGBACE1ALOX5
SCHEMBL6860280 0.81 GPR35 (0.39) GPR35ACHELIPGBACE1ALOX5
SCHEMBL6855598 0.79 GPR35 (0.38) GPR35ACHELIPGBACE1ALOX5
SCHEMBL28876813 0.78 GPR35 (0.40) GPR35ACHELIPGBACE1ALOX5
SCHEMBL2279352 0.76 GPR35 (0.51) GPR35ACHELIPGALOX5TYR
SCHEMBL1156926 0.76 GPR35 (0.51) GPR35ACHELIPGALOX5TYR
SCHEMBL1459454 0.76 GPR35 (0.51) GPR35ACHELIPGALOX5TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116655707-A End group functionalized polymer catalyst and synthesis method and application thereof 秦宁(南京)新材科技有限公司 2023-08-29 CN claimed
CN-116655707-A End group functionalized polymer catalyst and synthesis method and application thereof 秦宁(南京)新材科技有限公司 2023-08-29 CN disclosed