SCHEMBL9428587

SCHEMBL9428587

CC(C)(c1ccc(Oc2nc(NCCCCCC(=O)O)nc(NCCCCC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)n2)cc1)c1ccc(Oc2nc(NCCCCCC(=O)O)nc(NCCCCC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.31
PTGER3 P43115 1/20 0.31
PTGER2 P43116 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
TBXA2R P21731 2/20 0.30
FFAR4 Q5NUL3 1/20 0.30
ADAMTS4 O75173 1/20 0.30
ADAMTS5 Q9UNA0 1/20 0.30
TBXAS1 P24557 1/20 0.30

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
SCHEMBL9428019 0.87 KDM5A (0.35) PTGER3PTGER2
SCHEMBL9428549 0.87 PKM (0.30) KMT2A
SCHEMBL9428340 0.87
SCHEMBL9429180 0.83 KDM4E (0.35) KDM4EKMT2A
SCHEMBL9429263 0.80 NAAA (0.33)
SCHEMBL9428948 0.79 SMN1; SMN2 (0.35)
SCHEMBL9428807 0.79 KDM5A (0.33)
SCHEMBL1231055 0.78 TNKS2 (0.34)
SCHEMBL9428455 0.77 KMT2A (0.38) ALDH1A1KMT2A
SCHEMBL9428560 0.77 KMT2A (0.38) ALDH1A1KMT2A

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
US-5300544-A Non-migrating 1-hydrocarbyloxy-2,2,6,6-tetramethylpiperdine 1,3,5-triazine derivatives as polymer stabilizers CIBA-GEIGY CORPORATION (US) 1994-04-05 US disclosed
US-5216156-A Stabilizers having functional groups which chemically bond with polymer substrates CIBA-GEIGY CORPORATION (US) 1993-06-01 US disclosed