SCHEMBL23565249

SCHEMBL23565249

C=Cc1ccc(CNC(=O)CC(C)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 4/20 0.47
TGM2 P21980 1/20 0.42
PRSS1 P07477 1/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 4/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL13864006 0.85 TPSAB1 (0.44) TPSAB1TGM2HPGDLMNAALDH1A1
SCHEMBL13112977 0.85 TPSAB1 (0.49) TPSAB1TGM2PRSS1KMT2ACA1
SCHEMBL4607284 0.84 KMT2A (0.58) TGM2KMT2AALDH1A1RAB9A
SCHEMBL13101225 0.83 TPSAB1 (0.47) TPSAB1TGM2PRSS1KMT2ALMNA
SCHEMBL14732584 0.82 CYP3A4 (0.56) TPSAB1KMT2AHPGDLMNAALDH1A1
SCHEMBL8430211 0.81 TPSAB1 (0.44) TPSAB1TGM2PRSS1KMT2AHPGD
SCHEMBL24242093 0.81 HSD17B10 (0.51) KMT2AHPGDLMNAALDH1A1NPC1
SCHEMBL15292556 0.80 HPGD (0.66) TPSAB1HPGDLMNAALDH1A1
SCHEMBL14341628 0.79 CYP2D6 (0.50) TPSAB1TGM2KMT2AHPGDLMNA
SCHEMBL14732580 0.78 EPHX2 (0.64) HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174804-A1 Aqueous Resin Based Inkjet Ink AGFA NV (BE) 2023-06-08 US disclosed
US-20230167319-A1 Fluid Set for Inkjet Printing AGFA NV (BE) 2023-06-01 US disclosed
WO-2021224046-A1 FLUID SET FOR INKJET PRINTING AGFA NV (BE) 2021-11-11 WO disclosed
WO-2021224037-A1 AQUEOUS RESIN BASED INKJET INK AGFA NV (BE) 2021-11-11 WO disclosed
WO-2021122411-A2 AQUEOUS DISPERSION OF POLYMERIC CAPSULES AGFA NV (BE) 2021-06-24 WO disclosed