SCHEMBL24072758

SCHEMBL24072758

CCCCNc1ccc(C(=O)Nc2ncc(NC)s2)c(OCC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ TSHR P16473 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ PNLIP P16233 1/20 0.39
▸ F2R P25116 2/20 0.39
▸ HPGD P15428 1/20 0.38
▸ MITF O75030 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38

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
SCHEMBL24073630 0.87 ALDH1A1 (0.41) ALDH1A1LMNAGAATDP1MAPK1
SCHEMBL24073700 0.87 MAPK14 (0.42) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL30142728 0.84 ATG4B (0.54) ALDH1A1LMNAMAPK1MEN1KMT2A
SCHEMBL25063086 0.84 ATG4B (0.54) ALDH1A1LMNAMAPK1MEN1KMT2A
SCHEMBL27134459 0.80 ALDH1A1 (0.53) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL24072486 0.78 ALDH1A1 (0.43) ALDH1A1LMNAGAAMAPK1MEN1
SCHEMBL24073964 0.78 ALDH1A1 (0.39) ALDH1A1LMNAGAAMAPK1ALOX15
SCHEMBL24074042 0.76 ALDH1A1 (0.42) ALDH1A1LMNAMAPK1MEN1KMT2A
SCHEMBL25063112 0.76 ATG4B (0.52) ALDH1A1LMNATDP1MAPK1MEN1
SCHEMBL30142823 0.76 ATG4B (0.52) ALDH1A1LMNATDP1MAPK1MEN1

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-2021239117-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI) , INC. (CN) 2021-12-02 — — WO disclosed
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