SCHEMBL28814855

SCHEMBL28814855

CCc1cnc(CC(Cc2ccccc2)OC=O)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.37
CTSK P43235 4/20 0.36
CAPN1 P07384 1/20 0.36
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
DAO P14920 2/20 0.35
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
PDE10A Q9Y233 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
BRS3 P32247 5/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TAAR1 Q96RJ0 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
SCHEMBL18085416 0.77 EPHX1 (0.48) CTSKCTSLCTSBMDM2MEN1
SCHEMBL27985238 0.76 CTSK (0.36) CTSKCTSLCTSBPPARGPPARA
SCHEMBL28113592 0.76 TSHR (0.42) CTSKDAOMEN1KMT2ATAAR1
SCHEMBL28045695 0.72 CTSK (0.34) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL28095278 0.71 CTSK (0.54) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL12630161 0.70 ACE (0.44) CTSKCTSLCTSBPPARGPPARA
SCHEMBL28074772 0.69 CTSK (0.36) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL28045730 0.69 CTSK (0.37) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL28061404 0.68 EPHX1 (0.35) CTSKCTSLCTSBMEN1KMT2A
SCHEMBL27498107 0.68 BRD4 (0.42) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104016925-B The synthetic method of 4-alkyl imidazole-2-carboxylic acid ZUNYI MEDICAL COLLEGE (CN) 2016-03-30 CN disclosed
CN-104016925-A Method for synthesizing 4-alkylimidazole-2-carboxylic acid I UNIV ZUNYI MEDICAL 2014-09-03 CN disclosed