SCHEMBL31534075

SCHEMBL31534075

Cc1[nH]c2ccc(Cl)cc2c1CCOc1nc(-c2cccnc2O)nc2scnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
HTR7 P34969 1/20 0.38
HTR2B P41595 1/20 0.38
HTR6 P50406 1/20 0.38
MEN1 O00255 7/20 0.36
KMT2A Q03164 7/20 0.36
ATM Q13315 2/20 0.36
MAPT P10636 3/20 0.36
HTT P42858 3/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 3/20 0.35
LMNA P02545 2/20 0.35
HTR1A P08908 1/20 0.34
SNCA P37840 1/20 0.33
MMP2 P08253 3/20 0.33
MCL1 Q07820 1/20 0.33
MMP9 P14780 2/20 0.32

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
SCHEMBL27321109 0.90 KMT2A (0.36) MEN1KMT2AATMMAPTHTT
SCHEMBL30867146 0.90 KMT2A (0.36) MEN1KMT2AATMMAPTHTT
SCHEMBL27320293 0.85 ADRA2A (0.37) ADRA2AADRA2BADRA2CHTR7HTR2B
SCHEMBL30867128 0.84 HPGD (0.39) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL27320667 0.84 HPGD (0.39) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL27320013 0.83 HTR6 (0.46) ADRA2AADRA2BADRA2CHTR7HTR2B
SCHEMBL31534054 0.83 HTR6 (0.46) ADRA2AADRA2BADRA2CHTR7HTR2B
SCHEMBL27321096 0.75 KMT2A (0.35) MEN1KMT2AATMMAPTHTT
SCHEMBL30867147 0.75 IP6K1 (0.41) HTR6MEN1KMT2AATMMAPT
SCHEMBL27319539 0.75 IP6K1 (0.41) HTR6MEN1KMT2AATMMAPT

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