SCHEMBL27324959

SCHEMBL27324959

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

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
CHRM1 P11229 5/20 0.41
CHRM2 P08172 3/20 0.41
CHRM4 P08173 3/20 0.41
CHRM5 P08912 3/20 0.41
CHRM3 P20309 3/20 0.41
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 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
SCHEMBL14556036 0.88 MEN1 (0.38) MEN1KMT2A
SCHEMBL1311902 0.78 RAB9A (0.65) RAB9ACHRM1CHRM2CHRM4CHRM5
SCHEMBL15600814 0.74 MEN1 (0.33) MEN1KMT2A
SCHEMBL27324722 0.72 MEN1 (0.32) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9618748 0.69 RAB9A (0.38) RAB9AKDM4EALDH1A1HPGD
SCHEMBL12590734 0.69
SCHEMBL16804663 0.69
SCHEMBL19146946 0.69 RAB9A (0.54) RAB9ACHRM1CHRM2CHRM4CHRM5
SCHEMBL9618829 0.67
SCHEMBL936199 0.67

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