SCHEMBL26157078

SCHEMBL26157078

CC(C)C(=O)NCc1ccc(-c2nncnn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ERCC1 P07992 1/20 0.50
▸ ERCC4 Q92889 1/20 0.50
▸ HDAC1 Q13547 2/20 0.46
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ PTGES O14684 4/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ SMO Q99835 1/20 0.39
▸ MEN1 O00255 1/20 0.38

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
SCHEMBL21151955 0.85 ERCC1 (0.50) ERCC1ERCC4HDAC1KMT2ALMNA
SCHEMBL12103897 0.83 KMT2A (0.56) HDAC1KMT2AMAPTKDM4ETP53
SCHEMBL24558042 0.82 ERCC1 (0.64) ERCC1ERCC4HDAC1KMT2ALMNA
SCHEMBL25511293 0.81 KMT2A (0.41) HDAC1KMT2AMAPTKDM4ETP53
SCHEMBL12131750 0.80 ERCC1 (0.70) ERCC1ERCC4HDAC1KMT2ALMNA
SCHEMBL21422726 0.80 TPSAB1 (0.46) HDAC1KMT2ALMNAEPHX2ALDH1A1
SCHEMBL23031994 0.79 RIPK1 (0.42) HDAC1MAPTKDM4ETP53EPHX2
SCHEMBL15748044 0.78 CYP3A4 (0.55) HDAC1KMT2AKDM4EEPHX2ALDH1A1
SCHEMBL27353844 0.78 HPGDS (0.49) ERCC1ERCC4HDAC1KMT2AMAPT
SCHEMBL22009219 0.78 TSHR (0.39) HDAC1KMT2ALMNAALDH1A1CYP3A4

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
WO-2023094525-A1 IMPROVED ANTIBODY-PAYLOAD CONJUGATES (APCS) PREPARED BY SITE-SPECIFIC CONJUGATION UTILIZING GENETIC CODE EXPANSION VERAXA BIOTECH GMBH (DE) 2023-06-01 — — WO disclosed
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