SCHEMBL11059596

SCHEMBL11059596

O=C1c2ccccc2C(=O)c2c(NCCc3ccccc3)ccc(NCCc3ccccc3)c21

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.77
NPC1 O15118 2/20 0.77
MTOR P42345 1/20 0.77
SIRT2 Q8IXJ6 1/20 0.77
MEN1 O00255 8/20 0.64
KMT2A Q03164 8/20 0.64
POLB P06746 4/20 0.64
BLM P54132 3/20 0.64
NSD2 O96028 2/20 0.64
RXFP1 Q9HBX9 1/20 0.64
P2RY4 P51582 1/20 0.60
TLR9 Q9NR96 2/20 0.58
HSP90AA1 P07900 1/20 0.58
G6PD P11413 1/20 0.58
CCR6 P51684 1/20 0.58
HKDC1 Q2TB90 1/20 0.58
TOP2B Q02880 1/20 0.58
RPS6KA3 P51812 1/20 0.49
RPS6KA2 Q15349 1/20 0.49
RPS6KA1 Q15418 1/20 0.49

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
SCHEMBL11172903 0.91 RAB9A (0.66) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL6366938 0.88 RAB9A (0.61) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL29895852 0.87 NPC1 (1.00) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL3886741 0.87 NPC1 (1.00) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL30513725 0.87 NPC1 (1.00) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL10730115 0.85 NPC1 (0.58) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL11334587 0.82 MEN1 (0.58) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL18134578 0.81 NPC1 (0.87) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL11803000 0.80 NPC1 (0.59) RAB9ANPC1MTORSIRT2MEN1
SCHEMBL1426702 0.79 TOP2B (0.81) RAB9ANPC1MTORSIRT2MEN1

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
CN-119101344-A Laser welding polyphenyl ether alloy and preparation method thereof 广东兴盛迪科技有限公司 2024-12-10 CN claimed
CN-119101344-A Laser welding polyphenyl ether alloy and preparation method thereof 广东兴盛迪科技有限公司 2024-12-10 CN disclosed
US-4451398-A Dyes containing imidazolymethylene groups BASF AKTIENGESELLSCHAFT (DE) 1984-05-29 US disclosed