Sugi Predict

Sugi Predict / Compounds / SCHEMBL9428448

SCHEMBL9428448

SCHEMBL9428448

CC1(C)CC(CCCCCCCCCCCCNc2nc(Cl)nc(NCCCCCCCCCCCCC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)n2)CC(C)(C)N1OC1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.38
▸ PDE4A P27815 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.32
▸ TNKS2 Q9H2K2 1/20 0.31

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
SCHEMBL9429087 1.00 KMT2A (0.38) KMT2APDE4ASIGMAR1TNKS2
SCHEMBL452494 0.99 KMT2A (0.36) KMT2APDE4ASIGMAR1TNKS2
SCHEMBL524341 0.97 KMT2A (0.33) KMT2ASIGMAR1TNKS2
SCHEMBL1231055 0.93 TNKS2 (0.34) SIGMAR1TNKS2
SCHEMBL9428560 0.89 KMT2A (0.38) KMT2ASIGMAR1TNKS2
SCHEMBL9428473 0.89 TLR7 (0.35) KMT2ASIGMAR1TNKS2
SCHEMBL9428455 0.89 KMT2A (0.38) KMT2ASIGMAR1TNKS2
SCHEMBL9428298 0.88 CTSS (0.32) PDE4ASIGMAR1TNKS2
SCHEMBL526852 0.88 KMT2A (0.36) KMT2ATNKS2
SCHEMBL9428266 0.88 TLR7 (0.36) SIGMAR1TNKS2

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