SCHEMBL31662701

SCHEMBL31662701

CNc1cc(CN2C(=O)C(Cl)=C(Cl)C2O)ccc1N1CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.37
DRD2 P14416 4/20 0.37
HTR2A P28223 4/20 0.37
HTR2C P28335 4/20 0.37
DRD3 P35462 4/20 0.37
ADRB2 P07550 2/20 0.37
HTR1D P28221 2/20 0.37
HTR1B P28222 2/20 0.37
ADRA1B P35368 2/20 0.37
HTR2B P41595 2/20 0.37
MRGPRX1 Q96LB2 2/20 0.37
HTR1A P08908 3/20 0.33
DRD4 P21917 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
DPP4 P27487 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
USP28 Q96RU2 4/20 0.33

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
SCHEMBL31662803 0.84 HTR1A (0.35) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL31663171 0.82 SMN1; SMN2 (0.41) MAPTBACE1TP53
SCHEMBL31662775 0.80 ADRB1 (0.45) HTR6HTR2AHTR2CHTR2BHTR1A
SCHEMBL31663179 0.74 TLR7 (0.39) HTR2AHTR2C
SCHEMBL31662836 0.73 KDM4E (0.36) MAPTTP53
SCHEMBL31662902 0.73 ALDH1A1 (0.35) ADRA1BPOLBMAPTMAPKAPK2
SCHEMBL31663164 0.72 ADRB1 (0.45) HTR6HTR2AHTR2CHTR2BHTR1A
SCHEMBL31662697 0.71 BRD4 (0.38) MAPT
SCHEMBL24624436 0.70 CAPN1 (0.37) TP53
SCHEMBL31663172 0.70 RORC (0.39) POLB

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