SCHEMBL30451870

SCHEMBL30451870

COc1ccc(CNc2ccnc3ccc(-c4cc(Cl)ccc4OC)cc23)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 17/20 0.55
CYP3A4 P08684 17/20 0.55
CYP2C19 P33261 15/20 0.55
CLK4 Q9HAZ1 14/20 0.55
ALDH1A1 P00352 12/20 0.55
LMNA P02545 12/20 0.55
HSD17B10 Q99714 11/20 0.55
TSHR P16473 10/20 0.55
CYP2C9 P11712 9/20 0.55
CYP2D6 P10635 14/20 0.50
USP2 O75604 12/20 0.49
MAPK1 P28482 7/20 0.49
HIF1A Q16665 6/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 1/20 0.49
HTR1A P08908 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48

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
SCHEMBL24252882 1.00 CYP1A2 (0.55) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL24252970 0.92 HTR1A (0.50) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL30451317 0.80 CYP1A2 (0.46) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL24252808 0.80 CYP1A2 (0.46) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL24252876 0.79 HTR1A (0.56) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL30452049 0.78 CYP1A2 (0.55) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL24252936 0.78 CYP1A2 (0.55) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL30451335 0.77 CYP1A2 (0.51) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL24252742 0.77 CYP1A2 (0.51) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1
SCHEMBL30467726 0.77 CYP1A2 (0.43) CYP1A2CYP3A4CYP2C19CLK4ALDH1A1

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
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed
EP-4185592-A1 INHIBITORS OF COMPLEMENT FACTORS AND USES THEREOF Annexon, Inc. (US) 2023-05-31 EP disclosed