SCHEMBL31049600

SCHEMBL31049600

CCC(C)(C)Nc1nncc(C=CN(C)C)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL31049622 0.81 ELANE (0.31) RAB9ASMN1; SMN2
SCHEMBL31049697 0.73 CCNE2 (0.34)
SCHEMBL31049557 0.63 MAPT (0.30)
SCHEMBL31049656 0.63 MTNR1A (0.31)
SCHEMBL23612391 0.58 ALDH1A1 (0.46)
SCHEMBL23244419 0.54 KDM4E (0.50)
SCHEMBL24250866 0.54 CYP11B2 (0.34) RAB9A
SCHEMBL462035 0.52 AR (0.39)
SCHEMBL3260017 0.51 PDE4A (0.49) RAB9ASMN1; SMN2
SCHEMBL12500123 0.50 GRM4 (0.55) RAB9ASMN1; SMN2

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
CN-118619931-A Aryl or heteroaryl derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-09-10 CN disclosed