SCHEMBL30369747

SCHEMBL30369747

CCC(C)C(N)C1=NCCS1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
LMNA P02545 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
DPP4 P27487 4/20 0.32
DPP8 Q6V1X1 3/20 0.32
DPP9 Q86TI2 3/20 0.32
DPP7 Q9UHL4 2/20 0.32

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
SCHEMBL19474620 0.76
SCHEMBL593348 0.76
SCHEMBL10037148 0.71
SCHEMBL4964447 0.68 DPP4 (0.41) DPP4DPP8DPP9DPP7
SCHEMBL4964448 0.68 DPP4 (0.41) DPP4DPP8DPP9DPP7
SCHEMBL295597 0.68 DPP4 (0.41) DPP4DPP8DPP9DPP7
SCHEMBL27953924 0.68 SMN1; SMN2 (0.33) SMN1; SMN2NOS3NOS1NOS2
SCHEMBL28079334 0.68 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL17075357 0.67
SCHEMBL27419376 0.67

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
EP-4125994-A1 PROCESSES AND AGENTS FOR GLAUCOMA Aufbau Medical Innovations Limited (IE) 2023-02-08 EP disclosed