SCHEMBL27324722

SCHEMBL27324722

CC(C)C#CCN(C(C)C)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL14556036 0.82 MEN1 (0.38) MEN1KMT2A
SCHEMBL12590734 0.74
SCHEMBL15600814 0.74 MEN1 (0.33) MEN1KMT2A
SCHEMBL27324959 0.72 RAB9A (0.46) MEN1KMT2ACHRM2CHRM4CHRM5
SCHEMBL16804663 0.69
SCHEMBL26402885 0.69 CHRM2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24508580 0.67 PIK3CD (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9869603 0.65
SCHEMBL6585130 0.65 CHRM2 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1583202 0.65 MAOB (0.37) MEN1KMT2A

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
WO-2024097547-A1 HIGH PURITY ALKYNYL AMINES FOR SELECTIVE DEPOSITION VERSUM MATERIALS US, LLC (US) 2024-05-10 WO disclosed