SCHEMBL19797901

SCHEMBL19797901

Cc1ncn(C)c1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 4/20 0.41
APOBEC3G Q9HC16 3/20 0.41
MEN1 O00255 1/20 0.37
PABPC1 P11940 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 3/20 0.34
ALDH1A1 P00352 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 1/20 0.33
CTDSP1 Q9GZU7 2/20 0.33
BCAT2 O15382 1/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PKM P14618 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL7375007 0.82 APOBEC3A (0.38) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL3054669 0.81 APOBEC3A (0.42) APOBEC3AAPOBEC3GKMT2ALMNAALDH1A1
SCHEMBL23716719 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GKMT2ALMNAALDH1A1
SCHEMBL13651663 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL13030147 0.79 APOBEC3A (0.49) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL2202785 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL23367000 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GLMNAALDH1A1DPP4
SCHEMBL20360594 0.79 KDM4E (0.49) APOBEC3AAPOBEC3GKMT2AALDH1A1KDM4E
SCHEMBL23716720 0.78 APOBEC3A (0.40) APOBEC3AAPOBEC3GLMNAALDH1A1CTDSP1
SCHEMBL28415122 0.78 APOBEC3A (0.40) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A

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
WO-2024261328-A1 AMIDE-AMINE COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2024-12-26 WO disclosed
EP-3487840-B1 CYCLOHEXYL BENZAMIDE COMPOUNDS LILLY CO ELI (US) 2021-08-11 EP disclosed
WO-2018014800-A1 CYCLOHEXYL BENZAMIDE COMPOUNDS ELI LILLY AND COMPANY (US) 2018-01-25 WO disclosed