Sugi Predict

Sugi Predict / Compounds / SCHEMBL25714643

SCHEMBL25714643

SCHEMBL25714643

CCC(=CC(C)C)N1CCCC1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ KDM4A O75164 1/20 0.30
▸ FBP1 P09467 1/20 0.30
▸ MGLL Q99685 1/20 0.30
▸ F2 P00734 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
SCHEMBL6941541 0.79 L3MBTL1 (0.37) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL6941543 0.79 L3MBTL1 (0.37) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL11793410 0.77 F2 (0.40) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL11793406 0.77 F2 (0.40) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL3311150 0.73 L3MBTL1 (0.33) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL3311147 0.73 L3MBTL1 (0.33) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL3307979 0.71 F2 (0.36) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL3307989 0.71 F2 (0.36) L3MBTL1MEN1KMT2ATDP1KDM4A
SCHEMBL9484922 0.70 ALDH1A1 (0.33) —
SCHEMBL9484926 0.70 ALDH1A1 (0.33) —

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-2023104035-A1 SUBSTITUTED MONOCYCLIC OR BICYCLIC HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 英矽智能科技(上海)有限公司 2023-06-15 — — WO disclosed