SCHEMBL31662909

SCHEMBL31662909

CC(=O)Nc1ccc(CN2C(=O)C(Cl)=C(Cl)C2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 1/20 0.48
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
HTT P42858 3/20 0.42
TSHR P16473 2/20 0.41
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
OPRM1 P35372 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL31662836 0.85 KDM4E (0.36) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL31662651 0.84 CA1 (0.40) ALDH1A1KMT2AMEN1HTTMAPT
SCHEMBL31662812 0.83 PTGDR2 (0.46) HDAC3HDAC8CA12CA1CA9
SCHEMBL24624434 0.80 MAPT (0.42) ALDH1A1KDM4EKMT2AMEN1HTT
SCHEMBL24624436 0.78 CAPN1 (0.37) KDM4ETP53RAB9A
SCHEMBL31662895 0.77 PTGS1 (0.47) ALDH1A1KDM4EKMT2AMEN1HTT
SCHEMBL31662790 0.77 LMNA (0.38) ALDH1A1KDM4ETSHRMAPTHDAC6
SCHEMBL17987976 0.76 KMT2A (0.47) ALDH1A1KDM4EKMT2AMEN1HTT
SCHEMBL31662937 0.76 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2AMEN1HTT
SCHEMBL17962566 0.74 FAAH (0.45) KDM4EKMT2AMEN1HTTTSHR

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