SCHEMBL30397972

SCHEMBL30397972

Cc1cc(-n2nc3ccc(S(=O)(=O)c4ccc(C(C)C)cc4)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
POLB P06746 4/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
PKM P14618 1/20 0.39
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HTR6 P50406 1/20 0.35
CA2 P00918 1/20 0.34
TYR P14679 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
NR1I2 O75469 2/20 0.31
PTGS1 P23219 2/20 0.31

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
SCHEMBL30397522 0.89 POLB (0.46) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL21586956 0.89 POLB (0.46) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL547085 0.84 POLB (0.44) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL29568114 0.84 POLB (0.44) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL10604434 0.83 POLB (0.44) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL30631659 0.81 NPC1 (0.42) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL8351052 0.80 POLB (0.35) NPC1RAB9APOLBALDH1A1SMN1; SMN2
SCHEMBL9265339 0.79 KMT2A (0.37) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL9265042 0.79 NR1I2 (0.36) NPC1RAB9APOLBALDH1A1LMNA
SCHEMBL21586972 0.79 POLB (0.37) NPC1RAB9APOLBALDH1A1LMNA

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-113490710-B Polycarbonate resin composition 帝人株式会社 2023-05-05 CN disclosed