SCHEMBL31662937

SCHEMBL31662937

CN(C)c1ccc(CN2C(=O)C(Cl)=C(Cl)C2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 5/20 0.39
HTT P42858 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PARP1 P09874 1/20 0.36
HKDC1 Q2TB90 2/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
CACNA1G O43497 1/20 0.35
CACNA1H O95180 1/20 0.35
CACNA1I Q9P0X4 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
G6PD P11413 1/20 0.35
CCR6 P51684 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
RORC P51449 1/20 0.34

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
SCHEMBL31662947 0.85 HDAC1 (0.38) ALDH1A1KDM4ETSHRHKDC1HPGD
SCHEMBL31662790 0.80 LMNA (0.38) ALDH1A1KDM4ECYP3A4TSHRTDP1
SCHEMBL17987976 0.80 KMT2A (0.47) ALDH1A1KDM4EHTTCYP3A4TSHR
SCHEMBL31662836 0.79 KDM4E (0.36) ALDH1A1KDM4ECYP3A4HKDC1MAPT
SCHEMBL17962619 0.79 KDM4E (0.56) ALDH1A1KDM4EHKDC1MAPTMEN1
SCHEMBL17962566 0.78 FAAH (0.45) KDM4EHTTTSHRHKDC1HPGD
SCHEMBL31662895 0.78 PTGS1 (0.47) ALDH1A1KDM4EHTTTDP1MAPT
SCHEMBL17962576 0.77 KDM4E (0.39) ALDH1A1KDM4ECYP3A4HKDC1MAPT
SCHEMBL31662810 0.76 HPGD (0.45) ALDH1A1CYP3A4TSHRMAPTHPGD
SCHEMBL31662909 0.76 ALDH1A1 (0.48) ALDH1A1KDM4EHTTCYP3A4TSHR

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