SCHEMBL30079180

SCHEMBL30079180

CN(C)C(=O)Nc1cnccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 5/20 0.45
▸ HDAC3 O15379 3/20 0.45
▸ HDAC2 Q92769 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ MAP4K1 Q92918 1/20 0.40
▸ KDM4C Q9H3R0 2/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KDM6B O15054 1/20 0.40
▸ KDM4A O75164 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KDM4D Q6B0I6 1/20 0.40
▸ TDP1 Q9NUW8 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
SCHEMBL7653834 1.00 HDAC1 (0.45) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL14357917 0.81 HDAC1 (0.46) HDAC1HDAC3HDAC2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL5749683 0.79 HDAC1 (0.45) HDAC1HDAC3HDAC2KDM4EALDH1A1
Hydrochloric Acid SCHEMBL29373586 0.79 HDAC1 (0.45) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL9017891 0.79 HDAC1 (0.49) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL15432248 0.78 KDM4E (0.51) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL28994432 0.77 TERT (0.48) HDAC1HDAC3HDAC2KDM4CHDAC8
SCHEMBL15432245 0.75 XIAP (0.45) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL23463919 0.75 HDAC1 (0.56) HDAC1HDAC3HDAC2KDM4EALDH1A1
SCHEMBL10206277 0.74 CA1 (0.46) HDAC1HDAC3HDAC2KDM4EALDH1A1

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-4672972-A1 METHOD AND APPARATUS FOR PREPARING FLAKES Landa Labs (2012) Ltd. (IL) 2026-01-07 — — EP disclosed
WO-2024180459-A1 METHOD AND APPARATUS FOR PREPARING FLAKES LANDA LABS (2012) LTD. (IL) 2024-09-06 — — WO disclosed
EP-3737684-B1 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES IDORSIA PHARMACEUTICALS LTD (CH) 2022-11-16 — — EP disclosed
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