SCHEMBL1960388

SCHEMBL1960388

CC(C)(C)C(=O)OOc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.49
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNN4 O15554 1/20 0.39
POLB P06746 2/20 0.38
ALOX15 P16050 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
SCHEMBL14506460 0.89 ELANE (0.47) ELANEALDH1A1NPC1LMNARAB9A
SCHEMBL27275827 0.84 L3MBTL1 (0.42) ELANEL3MBTL1ATMALDH1A1TSHR
SCHEMBL644718 0.81 RIPK1 (0.44) ELANEL3MBTL1ATMALDH1A1TSHR
SCHEMBL11446238 0.80 ELANE (0.46) ELANEALDH1A1MEN1KMT2APOLB
SCHEMBL637403 0.80 KCNN4 (0.42) ELANEL3MBTL1ATMALDH1A1TSHR
SCHEMBL2342588 0.78 ELANE (0.72) ELANEL3MBTL1ATMTDP1
Water SCHEMBL28352540 0.78 L3MBTL1 (0.38) ELANEL3MBTL1ATMALDH1A1TSHR
SCHEMBL13727895 0.78 L3MBTL1 (0.38) ELANEL3MBTL1ATMALDH1A1TSHR
SCHEMBL11443032 0.77 PPARA (0.53) ELANEMEN1KMT2A
Ammonia Solution, Strong SCHEMBL11257764 0.77 ELANE (0.70) ELANEL3MBTL1ATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507237-A1 IMIDAZOQUINOLINES WHICH ACT VIA TOLL - LIKE RECEPTORS (TLR) Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-10-10 EP claimed
EP-2507237-A1 IMIDAZOQUINOLINES WHICH ACT VIA TOLL - LIKE RECEPTORS (TLR) Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-10-10 EP disclosed
WO-2011068233-A1 IMIDAZOQUINOLINES WHICH ACT VIA TOLL - LIKE RECEPTORS (TLR) DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-06-09 WO disclosed
EP-1644352-A1 PROCESS FOR PREPARING ISOMERICALLY PURE PRODRUGS OF PROTON PUMP INHIBITORS Allergan, Inc. (US) 2006-04-12 EP disclosed
WO-2005016917-A1 PROCESS FOR PREPARING ISOMERICALLY PURE PRODRUGS OF PROTON PUMP INHIBITORS ALLERGAN, INC. (US) 2005-02-24 WO disclosed