SCHEMBL30867150

SCHEMBL30867150

COc1ccc2[nH]cc(CCNc3nc(Cl)nc4scnc34)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.54
CYP1A2 P05177 16/20 0.54
CYP3A4 P08684 16/20 0.54
CYP2D6 P10635 16/20 0.54
CYP2C19 P33261 16/20 0.54
USP2 O75604 14/20 0.54
CLK4 Q9HAZ1 14/20 0.54
CYP2C9 P11712 14/20 0.54
MAPK1 P28482 11/20 0.54
LMNA P02545 8/20 0.54
HIF1A Q16665 7/20 0.54
HSD17B10 Q99714 6/20 0.54
TSHR P16473 5/20 0.54
MEN1 O00255 7/20 0.51
KMT2A Q03164 7/20 0.51
ALDH1A1 P00352 6/20 0.51
ALOX15 P16050 7/20 0.51
TP53 P04637 4/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.50

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
SCHEMBL27320687 1.00 HTR2A (0.54) HTR2ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL27319892 0.88 MTNR1A (0.45) HTR2ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL30867149 0.88 MTNR1A (0.45) HTR2ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL30867205 0.88 IP6K1 (0.49) HTR2AHSD17B10TSHRHPGDMTNR1A
SCHEMBL27319968 0.86 MPO (0.51) HTR2AKMT2AMTNR1A
SCHEMBL30867143 0.86 MPO (0.51) HTR2AKMT2AMTNR1A
SCHEMBL30867137 0.83 HTT (0.49) HTR2AUSP2MAPK1LMNAMEN1
SCHEMBL27318656 0.83 HTT (0.49) HTR2AUSP2MAPK1LMNAMEN1
SCHEMBL30867135 0.83 HTT (0.49) HTR2AUSP2MAPK1LMNAMEN1
SCHEMBL30867201 0.82 CDK2 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19USP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598931-A1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2025-08-13 EP disclosed
CN-119948035-A Compounds useful for modulating AhR signaling 捷豹治疗有限公司 2025-05-06 CN disclosed
WO-2024076300-A1 COMPOUNDS USEFUL IN MODULATION OF AHR SIGNALLING JAGUAHR THERAPEUTICS PTE LTD (SG) 2024-04-11 WO disclosed