SCHEMBL25682015

SCHEMBL25682015

Cn1c(N)nc2cccc(C#N)c21

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.58
PSMB8 P28062 1/20 0.46
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
TLR8 Q9NR97 2/20 0.39
MAP2K1 Q02750 1/20 0.38
POLB P06746 1/20 0.35
LMNA P02545 1/20 0.35
IMPDH2 P12268 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
NOS2 P35228 1/20 0.33
RPS6KB1 P23443 1/20 0.33
ROCK1 Q13464 1/20 0.33
CXCR4 P61073 1/20 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
SCHEMBL1161620 0.76 PSMB8 (0.47) PRMT5PSMB8KDM4EALDH1A1LMNA
SCHEMBL5457312 0.75 PRMT5 (0.66) PRMT5KDM4EALDH1A1GAATLR8
SCHEMBL25175074 0.74 PRMT5 (0.37) PRMT5KDM4EALDH1A1GAATSHR
SCHEMBL25167934 0.74 TLR8 (0.36) PRMT5KDM4EALDH1A1GAATLR8
SCHEMBL31258624 0.74 TLR8 (0.36) PRMT5KDM4EALDH1A1GAATLR8
SCHEMBL5104145 0.74 PRMT5 (1.00) PRMT5PSMB8KDM4EGAATLR8
SCHEMBL5448072 0.74 PRMT5 (0.64) PRMT5PSMB8KDM4ETLR8POLB
SCHEMBL31258646 0.73 LTB4R (0.45) PRMT5KDM4EALDH1A1GAATLR8
SCHEMBL25168462 0.73 LTB4R (0.45) PRMT5KDM4EALDH1A1GAATLR8
Hydrochloric Acid SCHEMBL25175077 0.72 LTB4R (0.44) PRMT5KDM4EALDH1A1GAATLR8

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-2023081367-A2 2-AMINO IMIDAZOLE DERIVATIVES Mirati Therapeutics, Inc. (US) 2023-05-11 WO disclosed