SCHEMBL31534086

SCHEMBL31534086

Cn1cc(-c2ncc3nc(OCCc4c[nH]c5ccc(Cl)cc45)sc3n2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.39
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
HTR2A P28223 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
SLC6A4 P31645 2/20 0.36
IP6K1 Q92551 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
HCRTR2 O43614 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MET P08581 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
SCHEMBL30867210 0.82 HTR2A (0.39) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL31534090 0.80 HTR2A (0.39) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL27319874 0.79 HTR1A (0.39) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867162 0.79 HTR1A (0.39) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL30867144 0.78 HTR2A (0.44) HTR1ACDK4CCND1HTR2ATRPM8
SCHEMBL31534063 0.77 HTR1A (0.43) HTR1AHTR2ATRPM8SLC6A4KMT2A
SCHEMBL30867168 0.73 CDK4 (0.41) HTR1ACDK4CCND1SLC6A4GPR84
SCHEMBL30867190 0.73 GSK3B (0.41) HTR1ACDK4CCND1SLC6A4GPR84
SCHEMBL31534062 0.72 CDK4 (0.43) HTR1ACDK4CCND1SLC6A4GPR84
SCHEMBL31534077 0.72 GBA1 (0.41) HTR1ACDK4CCND1HTR2ASLC6A4

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
CN-119948035-A Compounds useful for modulating AhR signaling 捷豹治疗有限公司 2025-05-06 CN disclosed