SCHEMBL9682851

SCHEMBL9682851

CCCCCCCCON1C(C)(C)CC(N(c2nc(NCCCN(CCN(CCCNc3nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)n3)c3nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)n3)c3nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)nc(N(C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)C4CC(C)(C)N(OCCCCCCCC)C(C)(C)C4)n3)nc(N(C3CC(C)(C)N(OCCCCCCCC)C(C)(C)C3)C3CC(C)(C)N(OCCCCCCCC)C(C)(C)C3)n2)C2CC(C)(C)N(OCCCCCCCC)C(C)(C)C2)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 2/20 0.34
DNM2 P50570 7/20 0.32
CRHR1 P34998 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
KMT2A Q03164 1/20 0.31
TRIM58 Q8NG06 1/20 0.31
EHMT2 Q96KQ7 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
SCHEMBL9681446 0.92 DNM2 (0.38) DNM2KMT2ATRIM58EHMT2
SCHEMBL9680910 0.92 DNM2 (0.35) SLC29A1DNM2SMN1; SMN2KMT2AEHMT2
SCHEMBL7478763 0.90 SLC29A1 (0.33) SLC29A1CRHR1SMN1; SMN2KMT2A
SCHEMBL162808 0.84 SLC29A1 (0.30) SLC29A1
SCHEMBL12187141 0.84 SLC29A1 (0.32) SLC29A1CRHR1SMN1; SMN2
SCHEMBL6927282 0.80 SMN1; SMN2 (0.33) SLC29A1CRHR1SMN1; SMN2
SCHEMBL9682827 0.80 EHMT2 (0.36) EHMT2
SCHEMBL9428020 0.80 SLC29A1 (0.43) SLC29A1DNM2SMN1; SMN2KMT2A
SCHEMBL9680934 0.80
SCHEMBL12163332 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5118736-A Polymer stabilization against actinic radiation CIBA-GEIGY CORPORATION (US) 1992-06-02 US disclosed