SCHEMBL31569433

SCHEMBL31569433

CC1NCCn2ncc(N(C)C)c21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 3/20 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
SCHEMBL31569006 0.77
SCHEMBL31569009 0.71 MAPT (0.36)
SCHEMBL22014776 0.68 SMPD3 (0.36) SMPD3
SCHEMBL930158 0.62 TACR3 (0.33)
SCHEMBL928514 0.62 TACR3 (0.31)
Hydrochloric Acid SCHEMBL25411892 0.61 TACR3 (0.35)
Hydrochloric Acid SCHEMBL34469278 0.61 ATM (0.33)
Hydrochloric Acid SCHEMBL34469205 0.61 ATM (0.33)
SCHEMBL22282325 0.58 SMPD3 (0.34) SMPD3
SCHEMBL24942446 0.57 SLC6A2 (0.30)

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-2025101780-A1 PHARMACOLOGICAL CORRECTORS OF RHODOPSIN AND USES THEREOF OCTANT, INC. (US) 2025-05-15 WO disclosed