SCHEMBL28005138

SCHEMBL28005138

NC(=O)C(=CCC1CCCO1)CC1CCCO1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
ANPEP P15144 1/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MCL1 Q07820 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL554526 0.79 KMT2A (0.42) HPGDLMNASMN1; SMN2POLBUSP2
SCHEMBL554525 0.79 KMT2A (0.42) HPGDLMNASMN1; SMN2POLBUSP2
SCHEMBL21694428 0.78
SCHEMBL28463567 0.77 KMT2A (0.42) HPGDLMNASMN1; SMN2POLBUSP2
SCHEMBL14744490 0.75
SCHEMBL14744489 0.75
SCHEMBL2561552 0.75
SCHEMBL25322371 0.74 ALDH1A1 (0.45) HPGDLMNASMN1; SMN2POLBUSP2
SCHEMBL1412263 0.73 HPGD (0.41) HPGDLMNASMN1; SMN2POLBUSP2
SCHEMBL8171695 0.73 ALDH1A1 (0.42) HPGDLMNASMN1; SMN2POLBUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104334629-B Rubber composition for tire tread and pneumatic tire 住友橡胶工业株式会社 2016-08-24 CN disclosed
CN-104334629-A Tread rubber composition and pneumatic tire SUMITOMO RUBBER IND 2015-02-04 CN disclosed