SCHEMBL30954668

SCHEMBL30954668

CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 7/20 0.67
DPP4 P27487 7/20 0.67
NR1H2 P55055 1/20 0.61
NR1H3 Q13133 1/20 0.61
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
FAAH O00519 2/20 0.41
MGLL Q99685 1/20 0.41
DAO P14920 1/20 0.39
APAF1 O14727 1/20 0.39
POLB P06746 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
GABRA1 P14867 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
GABRB1 P18505 1/20 0.38

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
SCHEMBL17531021 1.00 ANPEP (0.67) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL13478139 0.93 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL29461625 0.93 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL18071847 0.93 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL29369271 0.93 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL3438530 0.93 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL24012151 0.89 DPP4 (0.58) ANPEPDPP4NR1H2NR1H3FAAH
SCHEMBL17151424 0.89 ANPEP (0.56) ANPEPDPP4NR1H2NR1H3NPC1
SCHEMBL300362 0.88 DPP4 (0.61) ANPEPDPP4NR1H2NR1H3HPGD
SCHEMBL2704512 0.88 ANPEP (0.55) ANPEPDPP4NR1H2NR1H3FAAH

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-118290920-A High-whiteness high-light-transmittance PCR (polymerase chain reaction) polymer composite material, preparation method and application thereof 广东特普爱高分子材料有限公司 2024-07-05 CN claimed