SCHEMBL27899007

SCHEMBL27899007

CC(CC(C(N)=O)N1Cc2c(OCc3ccc(CCl)cc3)cccc2C1=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ LMNA P02545 4/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ NCOA3 Q9Y6Q9 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ CRBN Q96SW2 7/20 0.38
▸ IKZF3 Q9UKT9 7/20 0.38
▸ PTGER1 P34995 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ITGB3 P05106 1/20 0.37

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
SCHEMBL27899070 0.89 CRBN (0.44) HTTLMNASMN1; SMN2L3MBTL1NCOA3
SCHEMBL27899276 0.89 HTT (0.38) HTTPOLBRECQLLMNASMN1; SMN2
SCHEMBL27881791 0.88 CRBN (0.51) HTTPOLBRECQLLMNASMN1; SMN2
SCHEMBL27899074 0.88 SLC1A5 (0.40) HTTSMN1; SMN2MAPTPTGER1PTGER4
SCHEMBL27899081 0.87 CRBN (0.44) HTTLMNASMN1; SMN2L3MBTL1NCOA3
SCHEMBL27899082 0.87 CRBN (0.48) HTTLMNASMN1; SMN2L3MBTL1NCOA3
SCHEMBL28802083 0.87 CRBN (0.53) HTTLMNASMN1; SMN2L3MBTL1NCOA3
SCHEMBL27899016 0.87 CRBN (0.48) CRBNIKZF3
SCHEMBL27899013 0.86 SMN1; SMN2 (0.41) HTTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL14311942 0.85 LMNA (0.41) HTTPOLBRECQLLMNASMN1; 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-102822165-A Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORP 2012-12-12 — — CN disclosed
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