SCHEMBL23974341

SCHEMBL23974341

CC(=O)C/C=C(/N)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
POLB P06746 1/20 0.31
TRPA1 O75762 1/20 0.30
TSHR P16473 1/20 0.30
THPO P40225 1/20 0.30

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
SCHEMBL10817873 0.78
SCHEMBL10817871 0.78
SCHEMBL11309739 0.76
SCHEMBL24358337 0.74 TRPA1 (0.36) LMNAALOX15BLMPMP22ALDH1A1
SCHEMBL20379537 0.74 TRPA1 (0.36) LMNAALOX15BLMPMP22ALDH1A1
SCHEMBL10001245 0.72 GLO1 (0.36) ALDH1A1TDP1TRPA1TSHRTHPO
Acetone SCHEMBL293563 0.72 TRPA1 (0.35) LMNAALOX15BLMPMP22ALDH1A1
SCHEMBL1785723 0.71
SCHEMBL9577379 0.70 MGAM (0.38) ALDH1A1TDP1TRPA1
SCHEMBL2130171 0.69 HTT (0.34) LMNAALOX15BLMPMP22TDP1

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
EP-3903825-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF Coherent Biopharma (Suzhou), Limited (CN) 2021-11-03 EP disclosed