SCHEMBL30480965

SCHEMBL30480965

CCCc1cncc(C)n1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.39
NOS2 P35228 2/20 0.39
NOS3 P29474 1/20 0.39
CYP2D6 P10635 1/20 0.35
HRH1 P35367 1/20 0.35
PDE10A Q9Y233 2/20 0.33
CTSK P43235 6/20 0.33
BACE1 P56817 1/20 0.32
CTSS P25774 3/20 0.32
KDM5B Q9UGL1 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL295055 1.00 NOS1 (0.39) NOS1NOS2NOS3CYP2D6HRH1
SCHEMBL10834770 0.88 CYP2D6 (0.38) NOS1NOS2NOS3CYP2D6HRH1
SCHEMBL511339 0.87 NOS2 (0.43) NOS2CYP2D6HRH1PDE10A
SCHEMBL9797653 0.85 NOS3 (0.40) NOS1NOS2NOS3CTSKBACE1
SCHEMBL25818388 0.85 KCNH2 (0.47) NOS2CYP2D6HRH1
SCHEMBL105987 0.81
SCHEMBL24618582 0.80 HRH4 (0.36) NOS1NOS2CYP2D6HRH1CYP11B1
SCHEMBL5302424 0.80 CYP2D6 (0.35) NOS1NOS2CYP2D6HRH1PDE10A
SCHEMBL29792040 0.80 HRH4 (0.36) NOS1NOS2CYP2D6HRH1CYP11B1
SCHEMBL4687448 0.79 NOS3 (0.36) NOS1NOS2NOS3CTSKBACE1

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
US-20250134141-A1 PROCESS FOR TREATING PLANT-BASED SUBSTRATES FOR FOOD PRODUCTS Voyage Foods, Inc. 2025-05-01 US disclosed
EP-4205565-A1 TOBACCO FILLING MATERIAL AND TOBACCO PRODUCT Japan Tobacco Inc. (JP) 2023-07-05 EP disclosed