SCHEMBL10688684

SCHEMBL10688684

CCC(=O)N1CCCc2c(C(C)N(C)CCCC(C#N)(Sc3ccccc3)c3cccc(OC)c3)ccc(OC)c21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 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
SCHEMBL9666606 0.94 TSHR (0.30) KMT2A
SCHEMBL10688676 0.86 ABCB1 (0.33) KMT2A
SCHEMBL10696071 0.86 SLC6A1 (0.31) —
SCHEMBL10691939 0.86 ABCB1 (0.35) KMT2A
SCHEMBL10693280 0.81 — —
SCHEMBL10695887 0.80 ABCB1 (0.34) KMT2A
SCHEMBL9668732 0.80 ABCB1 (0.42) KMT2A
SCHEMBL10697691 0.80 — —
SCHEMBL9666610 0.80 ABCB1 (0.34) KMT2A
SCHEMBL10693262 0.80 ABCB1 (0.34) KMT2A

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-4792559-A 1,2,3,4-tetrahydroquinoline substituted 5-aminopentanenitrile compounds and their use as calcium modulators ADIR ET COMPAGNIE (FR) 1988-12-20 — — US disclosed
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