SCHEMBL31662853

SCHEMBL31662853

COc1cc(CN2C(=O)C(Cl)=C(Cl)C2O)ccc1N1CCN(C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.41
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
UCHL1 P09936 4/20 0.40
ALDH1A1 P00352 3/20 0.39
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.38
KDM4E B2RXH2 3/20 0.37
USP30 Q70CQ3 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
WNT3 P56703 2/20 0.36
SFRP1 Q8N474 2/20 0.36
POLB P06746 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL31662710 0.90 HSD17B10 (0.42) MEN1KMT2AHSD17B10HRH2HRH1
SCHEMBL31662870 0.88 P2RX7 (0.41) LMNANPSR1
SCHEMBL31662897 0.82 ALDH1A1 (0.42) MEN1KMT2AHSD17B10HRH2HRH1
SCHEMBL31662829 0.77 VEGFA (0.41) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL31662831 0.76 MC4R (0.38) MEN1KMT2AALDH1A1KDM4ETDP1
SCHEMBL31663171 0.76 SMN1; SMN2 (0.41) MEN1KMT2ALMNANPSR1
SCHEMBL31662801 0.75 SMN1; SMN2 (0.53) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL31662958 0.73 GAA (0.44)
SCHEMBL5794632 0.72 HRH2 (0.53) MEN1KMT2AHSD17B10HRH2HRH1
SCHEMBL5794630 0.72 HRH2 (0.53) MEN1KMT2AHSD17B10HRH2HRH1

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-2025147756-A1 VIRAL SENSITIZERS COMPOSITIONS, METHODS AND USES THEREOF OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2025-07-17 WO disclosed