SCHEMBL20201643

SCHEMBL20201643

CCCCCN1CCN(C(C)C)C1=S

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GBA1 P04062 1/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
HTT P42858 1/20 0.31
EEF2K O00418 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
SCHEMBL18183427 0.85 MEN1 (0.31) MEN1KMT2A
SCHEMBL8146239 0.81 MEN1 (0.47) MEN1KMT2AALDH1A1GBA1GNAI3
SCHEMBL2602296 0.79 INMT (0.31)
SCHEMBL24742430 0.78
SCHEMBL18183429 0.77
SCHEMBL20204699 0.77 MEN1 (0.44) MEN1KMT2AALDH1A1LMNAGBA1
SCHEMBL8034075 0.76 KMT2A (0.55) MEN1KMT2AALDH1A1
SCHEMBL18183430 0.75 MEN1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL18183419 0.75 MEN1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL12909502 0.73 PER2 (0.40) MEN1KMT2AGBA1

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-2018098206-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 WO disclosed