SCHEMBL9575468

SCHEMBL9575468

CCN(CC)c1nc(NCCCCCCCCC2CC(C)(C)NC(C)(C)C2)nc(NCCCCCCCCC2CC(C)(C)NC(C)(C)C2)n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.31
TP53 P04637 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
SCHEMBL9575159 0.99 CA1 (0.34) CA1CA2CA9TSHRTP53
SCHEMBL10813615 0.93 KMT2A (0.34) CA1CA2CA9KMT2ATSHR
SCHEMBL9575473 0.90 CA1 (0.36) CA1CA2CA9TSHR
SCHEMBL11439865 0.90 KMT2A (0.32) CA1CA2CA9KMT2ATSHR
SCHEMBL9497036 0.89 SMN1; SMN2 (0.38) KMT2ATSHR
SCHEMBL9575343 0.89 SLC29A1 (0.37) KMT2A
SCHEMBL9367808 0.88 TSHR (0.36) KMT2ATSHR
SCHEMBL9575437 0.88 SLC29A1 (0.36) KMT2A
SCHEMBL11429671 0.88 TSHR (0.33) KMT2ATSHR
SCHEMBL294894 0.88 SLC29A1 (0.32) TSHR

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
EP-0227640-B1 POLYOLEFINS STABILISED BY BIS-(POLYALKYLPIPERIDINYL-AMINO)-1,3,5-TRIAZINES CIBA-GEIGY AG (CH) 1993-05-26 EP claimed
EP-0227640-B1 POLYOLEFINS STABILISED BY BIS-(POLYALKYLPIPERIDINYL-AMINO)-1,3,5-TRIAZINES CIBA-GEIGY AG (CH) 1993-05-26 EP disclosed