SCHEMBL24073630

SCHEMBL24073630

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.41
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 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 0.39
▸ MITF O75030 1/20 0.39
▸ GCK P35557 1/20 0.38
▸ HDAC3 O15379 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
SCHEMBL24072486 0.90 ALDH1A1 (0.43) ALDH1A1LMNAGAAMAPK1NPC1
SCHEMBL24072758 0.87 ALDH1A1 (0.40) ALDH1A1LMNAGAATDP1ALOX15
SCHEMBL24072286 0.87 ADORA2A (0.41) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL30142728 0.85 ATG4B (0.54) ALDH1A1LMNAMAPK1NPC1RAB9A
SCHEMBL25063086 0.85 ATG4B (0.54) ALDH1A1LMNAMAPK1NPC1RAB9A
SCHEMBL27134459 0.81 ALDH1A1 (0.53) ALDH1A1LMNAGAANPC1RAB9A
SCHEMBL24072566 0.80 TDP1 (0.36) LMNATDP1MAPK1RAB9ATSHR
SCHEMBL24073964 0.78 ALDH1A1 (0.39) ALDH1A1LMNAGAAALOX15MAPK1
SCHEMBL24072412 0.78 ALDH1A1 (0.63) ALDH1A1LMNAGAAALOX15MAPK1
SCHEMBL24072277 0.78 TDP1 (0.38) LMNATDP1MAPK1NPC1RAB9A

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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