SCHEMBL24072282

SCHEMBL24072282

Cc1cc(C(C)C)ccc1C(=O)Nc1ncc(N)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ STAT3 P40763 3/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ MITF O75030 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SORT1 Q99523 1/20 0.40
▸ MAPK14 Q16539 1/20 0.39
▸ PLG P00747 2/20 0.39
▸ KLK1 P06870 2/20 0.39
▸ KLK6 Q92876 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 2/20 0.38
▸ FADS1 O60427 1/20 0.38
▸ FBP1 P09467 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
SCHEMBL24073698 0.85 STAT3 (0.52) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL24072268 0.83 MAPK14 (0.47) CCNE1CDK2CDK5STAT3ALDH1A1
SCHEMBL24072759 0.83 CDK2 (0.40) CCNE1CDK2CDK5STAT3ALDH1A1
SCHEMBL24073701 0.82 POLQ (0.47) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL24072284 0.81 ADORA2A (0.44) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL25063151 0.81 STAT3 (0.64) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL24072271 0.81 ITK (0.43) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL24072346 0.81 STAT3 (0.41) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL24072273 0.81 TP53 (0.48) ALDH1A1RAB9ASMN1; SMN2NPC1MITF
SCHEMBL24074132 0.79 ALDH1A1 (0.54) STAT3ALDH1A1RAB9ASMN1; SMN2NPC1

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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