SCHEMBL29865451

SCHEMBL29865451

CC=Cc1cccc(C(C)CN2CCCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.42
GFER P55789 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL5998132 1.00 KDM4E (0.46) KDM4EKMT2ANPC1MEN1ALDH1A1
SCHEMBL5598219 1.00 KDM4E (0.46) KDM4EKMT2ANPC1MEN1ALDH1A1
SCHEMBL5598270 0.99 KDM4E (0.48) KDM4EKMT2ANPC1MEN1ALDH1A1
SCHEMBL29536930 0.84 KDM4E (0.47) KDM4EKMT2ANPC1ALDH1A1GFER
SCHEMBL21555691 0.84 KDM4E (0.47) KDM4EKMT2ANPC1ALDH1A1GFER
SCHEMBL11518269 0.77 HDAC4 (0.51) ALDH1A1SMN1; SMN2
SCHEMBL10447240 0.75 TAAR1 (0.50) SMN1; SMN2
SCHEMBL11200342 0.75 SMN1; SMN2 (0.51) KDM4EALDH1A1GFERL3MBTL1SMN1; SMN2
SCHEMBL8267685 0.74 ALDH1A1 (0.69) KDM4EKMT2ANPC1ALDH1A1GFER
SCHEMBL7792404 0.73 ALDH1A1 (0.67) KDM4EKMT2ANPC1ALDH1A1GFER

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-115066463-B Oil-extended modified conjugated diene polymer, method for preparing same, and rubber composition comprising same 株式会社LG化学 2023-06-20 CN disclosed
WO-2023085838-A1 RUBBER COMPOSITION COMPRISING BIOELASTIC BODY, AND PREPARATION METHOD THEREFOR 주식회사 엘지화학 2023-05-19 WO disclosed
CN-115066463-A Oil-extended modified conjugated diene polymer, method for producing same, and rubber composition containing same 株式会社LG化学 2022-09-16 CN disclosed