SCHEMBL31425751

SCHEMBL31425751

CC(NC(=O)c1ccc2ncccc2c1)c1ncccn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.66
TAS1R3 Q7RTX0 1/20 0.62
TAS1R1 Q7RTX1 1/20 0.62
ADORA2A P29274 4/20 0.58
ALOX15 P16050 1/20 0.58
HTT P42858 1/20 0.58
HDAC1 Q13547 1/20 0.53
HDAC2 Q92769 1/20 0.53
RAB9A P51151 3/20 0.53
ALDH1A1 P00352 3/20 0.53
NPC1 O15118 2/20 0.53
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
DOT1L Q8TEK3 1/20 0.52
POLB P06746 1/20 0.51
BCAT1 P54687 1/20 0.51
MAPT P10636 1/20 0.50
TRPM8 Q7Z2W7 1/20 0.50
CCR1 P32246 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL30025133 1.00 PLK1 (0.66) PLK1TAS1R3TAS1R1ADORA2AALOX15
SCHEMBL4986392 0.87 PLK1 (0.63) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL30024398 0.85 PLK1 (0.47) PLK1TAS1R3TAS1R1ADORA2AALOX15
SCHEMBL5006955 0.82 CLK1 (0.62) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL26697800 0.80 PLK1 (0.54) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL5007649 0.80 ROCK2 (0.63) TAS1R3TAS1R1
SCHEMBL11962154 0.80 PLK1 (1.00) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL703553 0.79 PLK1 (0.63) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL7464595 0.79 TAS1R3 (0.69) PLK1TAS1R3TAS1R1ALOX15HTT
SCHEMBL10273916 0.79 TAS1R3 (0.69) PLK1TAS1R3TAS1R1ALOX15HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119552151-B PRMT5 inhibitors and uses thereof 赛岚(杭州)生物医药科技有限公司 2025-05-02 CN disclosed
CN-119552151-A Novel PRMT5 inhibitors and uses thereof 赛岚(杭州)生物医药科技有限公司 2025-03-04 CN disclosed