SCHEMBL9526598

SCHEMBL9526598

CCOC(=O)C(C)(Cc1ccccc1)C(C)=O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 8/20 0.73
ALDH1A1 P00352 2/20 0.60
RECQL P46063 1/20 0.60
PIN1 Q13526 1/20 0.47
TAAR1 Q96RJ0 2/20 0.44
THRB P10828 1/20 0.44
PPID Q08752 1/20 0.43
POLB P06746 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 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
SCHEMBL8710582 0.92 MMP8 (0.79) MMP8ALDH1A1RECQLPIN1TAAR1
SCHEMBL27993635 0.84 MMP8 (0.69) MMP8ALDH1A1RECQLPIN1TAAR1
SCHEMBL16254170 0.84 MMP8 (0.54) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL12574782 0.83 MMP8 (0.63) MMP8ALDH1A1RECQLPIN1TAAR1
SCHEMBL1247153 0.83 MMP8 (0.68) MMP8ALDH1A1RECQLPIN1TAAR1
SCHEMBL14498571 0.82 MMP8 (0.51) MMP8ALDH1A1RECQLNPSR1SMN1; SMN2
SCHEMBL28817686 0.82 MMP8 (0.66) MMP8ALDH1A1RECQLPIN1LMNA
SCHEMBL1492859 0.81 MMP8 (0.65) MMP8ALDH1A1RECQLPIN1TAAR1
SCHEMBL22850601 0.81 MMP8 (0.53) MMP8ALDH1A1RECQLLMNASMN1; SMN2
SCHEMBL17403335 0.81 MMP8 (0.53) MMP8ALDH1A1RECQLPIN1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011014520-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-02-03 WO disclosed
EP-0310745-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE ORION-YHTYMÄ OY (FI) 1993-01-27 EP disclosed
EP-0183492-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1989-11-15 EP disclosed
EP-0310745-A2 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÄ OY (FI) 1989-04-12 EP disclosed
US-4689339-A 4-dihydroinden-2-yl-, 4-tetrahydronaphth-2-yl-, and 4-dihydrobenzofuran-2-ylimidazoles, useful to block α2 -adrenergic receptors FARMOS YHTYMA OY (FI) 1987-08-25 US disclosed
EP-0183492-A1 Substituted imidazole derivatives and their preparation and use Farmos-Yhtyma Oy (FI) 1986-06-04 EP disclosed