SCHEMBL28694451

SCHEMBL28694451

CCC(C)(C)c1cc(-c2ccc3[nH]nnc3c2-c2cc(C(C)(C)CC)cc(C(C)(C)CC)c2O)c(O)c(C(C)(C)CC)c1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP3 P42574 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 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
SCHEMBL5477964 0.89
SCHEMBL29733682 0.89
SCHEMBL3268199 0.85 NPC1 (0.34) NPC1LMNAMAPK1CASP3RAB9A
SCHEMBL29367588 0.85 NPC1 (0.34) NPC1LMNAMAPK1CASP3RAB9A
SCHEMBL30375701 0.85 NPC1 (0.34) NPC1LMNAMAPK1CASP3RAB9A
SCHEMBL30367475 0.84 HSP90AA1 (0.43)
SCHEMBL29011481 0.83 NPC1 (0.35) NPC1LMNAMAPK1CASP3RAB9A
SCHEMBL30367625 0.83 NPC1 (0.35) NPC1LMNAMAPK1CASP3RAB9A
SCHEMBL5316655 0.81 CYP1A2 (0.34)
SCHEMBL7189472 0.75 SMN1; SMN2 (0.40) NPC1LMNAMAPK1CASP3RAB9A

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-114149754-A Grid adhesive film and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2022-03-08 CN disclosed