SCHEMBL25375685

SCHEMBL25375685

CC(CO)(CO)CO.CCCCCCCOc1ccc(C2CC(=O)CC(=O)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
S1PR3 Q99500 2/20 0.45
NPC1 O15118 1/20 0.44
NR5A1 Q13285 1/20 0.43
RAB9A P51151 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PLA2G4B P0C869 2/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
RARB P10826 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
SCHEMBL30368405 0.90 LMNA (0.55) LMNAS1PR3NPC1NR5A1RAB9A
SCHEMBL30368533 0.90 LMNA (0.55) LMNAS1PR3NPC1NR5A1RAB9A
SCHEMBL30368396 0.89 LMNA (0.56) LMNAS1PR3NPC1NR5A1RAB9A
SCHEMBL6765500 0.86 NPC1 (0.56) LMNAS1PR3NPC1RAB9AMAPT
SCHEMBL30368319 0.80 MAPT (0.54) LMNANPC1RAB9AMAPT
SCHEMBL15740948 0.75 LMNA (0.50) LMNAS1PR3NPC1NR5A1RAB9A
SCHEMBL30368557 0.74 MAPT (0.52) LMNANPC1TP53TSHRMAPT
SCHEMBL29008637 0.73 MAPT (0.56) NPC1RAB9ATP53MAPTPKM
SCHEMBL16307340 0.73 NR5A1 (0.58) LMNAS1PR3NR5A1RAB9ATP53
SCHEMBL7004191 0.72 CRBN (0.55) LMNAS1PR3NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399510-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-12-14 US disclosed
EP-4239010-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-09-06 EP disclosed
CN-116323753-A Thermoplastic resin and optical lens comprising the same 三菱瓦斯化学株式会社 2023-06-23 CN disclosed