SCHEMBL29660586

SCHEMBL29660586

Cc1ccc(C(=O)c2ccc3nc4ccc(C(=O)c5ccc(C)c(C)c5)cc4c(-c4ccc(C)c(C)c4)c3c2)cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 1/20 0.49
ALDH1A1 P00352 6/20 0.44
NPC1 O15118 3/20 0.44
POLB P06746 3/20 0.44
MITF O75030 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAP3K14 Q99558 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
HPGD P15428 3/20 0.40
RAB9A P51151 3/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 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
SCHEMBL4596070 1.00 CHEK2 (0.49) CHEK2SMN1; SMN2HTTALDH1A1NPC1
SCHEMBL10441496 0.76 ALDH1A1 (0.51) SMN1; SMN2HTTALDH1A1NPC1LMNA
SCHEMBL30543769 0.75 MAPT (0.51) SMN1; SMN2HTTALDH1A1NPC1POLB
SCHEMBL4595649 0.75 MAPT (0.51) SMN1; SMN2HTTALDH1A1NPC1POLB
SCHEMBL47827 0.75 SMN1; SMN2 (0.79) SMN1; SMN2HTTALDH1A1NPC1POLB
SCHEMBL29514906 0.75 SMN1; SMN2 (0.79) SMN1; SMN2HTTALDH1A1NPC1POLB
SCHEMBL4595823 0.73 MAPT (0.50) CHEK2SMN1; SMN2HTTALDH1A1NPC1
SCHEMBL30543784 0.73 MAPT (0.50) CHEK2SMN1; SMN2HTTALDH1A1NPC1
SCHEMBL822303 0.73 SMN1; SMN2 (0.83) CHEK2SMN1; SMN2HTTALDH1A1NPC1
SCHEMBL8972079 0.73 NPC1 (0.51) ALDH1A1NPC1POLBLMNAMAPT

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-110114376-B Curable composition, method for producing cured product, cured product thereof, and adhesive using same 株式会社ADEKA 2022-06-14 CN disclosed