SCHEMBL9524836

SCHEMBL9524836

CC1(C)CC(CCCCCCCCCCCCNc2nc(NO)nc(NCCCCCCCCCCCCC3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.34
KCNH3 Q9ULD8 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
SCHEMBL9249642 0.99 TSHR (0.36) TSHRKMT2A
SCHEMBL9367808 0.93 TSHR (0.36) TSHRKMT2AKCNH3
SCHEMBL11168811 0.92 TSHR (0.36) TSHRKMT2AKCNH3
SCHEMBL10910185 0.89 KMT2A (0.40) TSHRKMT2AKCNH3
SCHEMBL10907331 0.88 KCNH3 (0.38) TSHRKMT2AKCNH3
SCHEMBL11101380 0.88 KMT2A (0.43) TSHRKMT2AKCNH3
SCHEMBL9861681 0.88 KCNH3 (0.38) TSHRKMT2AKCNH3
SCHEMBL10650353 0.87 TSHR (0.39) TSHRKMT2AKCNH3
SCHEMBL10811647 0.86 KMT2A (0.46) TSHRKMT2A
SCHEMBL10814703 0.86 KMT2A (0.46) TSHRKMT2A

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
EP-0427672-B1 POLYMER STABILIZERS CONTAINING BOTH HINDERED AMINE AND HYDROXYLAMINE MOIETIES CIBA-GEIGY AG (CH) 1993-09-29 EP claimed