SCHEMBL21564487

SCHEMBL21564487

CN1CCN(c2nc(CCCN)cn(-c3ccc(N(N)/C=C\N)cc3)c2=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL21564488 0.92 SYK (0.33) SYKMEN1KMT2A
SCHEMBL21564817 0.84 ALDH1A1 (0.35) MEN1KMT2AALDH1A1
SCHEMBL21564502 0.83
SCHEMBL21564498 0.83 SYK (0.33) SYK
SCHEMBL21564837 0.82 HRH4 (0.40) MEN1KMT2AALDH1A1
SCHEMBL21564512 0.80 ESR1 (0.30)
SCHEMBL21564626 0.80 CHEK1 (0.36) SYKMEN1KMT2AALDH1A1
SCHEMBL21564650 0.80 ESRRB (0.36) MEN1KMT2AALDH1A1
SCHEMBL23258181 0.79 JAK2 (0.39) SYKMEN1KMT2AALDH1A1
SCHEMBL23258205 0.78 SYK (0.39) SYKALDH1A1

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-2019217972-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. (US) 2019-11-14 WO disclosed