SCHEMBL23612119

SCHEMBL23612119

Fc1cccn1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ HDAC8 Q9BY41 2/20 0.52
▸ HDAC6 Q9UBN7 2/20 0.52
▸ CNR2 P34972 1/20 0.46
▸ ADRA1D P25100 1/20 0.45
▸ DBH P09172 1/20 0.44
▸ LMNA P02545 2/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ BRD2 P25440 1/20 0.42
▸ BRD3 Q15059 1/20 0.42
▸ BRDT Q58F21 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL27913383 0.76 ALDH1A1 (0.53) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL3195921 0.74 ALDH1A1 (0.52) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL27838313 0.74 HDAC8 (0.61) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL8878870 0.74 ALDH1A1 (0.52) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL27529223 0.74 ALDH1A1 (0.52) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL27700003 0.72 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL28110914 0.72 CYP11B1 (0.55) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL27944822 0.72 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL25119665 0.71 HDAC8 (0.45) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6
SCHEMBL3195611 0.71 HDAC8 (0.49) ALDH1A1KDM4EL3MBTL1HDAC8HDAC6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4085061-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM Due, Inc. (US) 2022-11-09 — — EP disclosed
CN-115279770-A Compounds and compositions for treating diseases associated with STING activity 艾福姆德尤股份有限公司 2022-11-01 — — CN disclosed
WO-2021138419-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC, (US) 2021-07-08 — — WO disclosed
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