SCHEMBL14119191

SCHEMBL14119191

CN(C)c1cccc(O)c1.O=C(O)Cc1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.61
▸ TSHR P16473 3/20 0.61
▸ CA2 P00918 1/20 0.58
▸ CAMK2A Q9UQM7 1/20 0.58
▸ MAPK1 P28482 1/20 0.46
▸ RAF1 P04049 1/20 0.46
▸ FNTA P49354 1/20 0.45
▸ FNTB P49356 1/20 0.45
▸ NLRP3 Q96P20 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ HSD17B1 P14061 1/20 0.43
▸ HSD17B2 P37059 1/20 0.43
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ ABCC4 O15439 1/20 0.42

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
Malonic Acid SCHEMBL14119875 0.82 ALDH1A1 (0.71) ALDH1A1TSHRCA2MAPK1CYP3A4
SCHEMBL2553049 0.80 KMT2A (0.54) ALDH1A1TSHRMAPK1KMT2AL3MBTL1
Resorcinol SCHEMBL8653289 0.80 CA2 (0.68) ALDH1A1TSHRCA2CAMK2AFNTA
Phenol SCHEMBL11244335 0.80 ALDH1A1 (0.87) ALDH1A1TSHRCA2MAPK1CYP3A4
Phenol SCHEMBL9774350 0.79 ALDH1A1 (0.77) ALDH1A1TSHRCA2CYP3A4KMT2A
Phenol SCHEMBL27873906 0.78 CA2 (0.86) TSHRCA2CAMK2AFNTAFNTB
SCHEMBL29616636 0.78 ALDH1A1 (1.00) ALDH1A1TSHRCA2CYP3A4HSD17B1
SCHEMBL43373 0.78 ALDH1A1 (1.00) ALDH1A1TSHRCA2CYP3A4HSD17B1
Benzene SCHEMBL28272878 0.78 CA2 (0.95) ALDH1A1TSHRCA2CAMK2AFNTA
Phenol SCHEMBL7869036 0.76 CA2 (0.83) TSHRCA2CAMK2AFNTAFNTB

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-2718379-B1 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AND PROCESSES THEREOF MERCK PATENT GMBH (DE) 2016-08-17 — — EP disclosed
EP-2718379-A1 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AND PROCESSES THEREOF AZ Electronic Materials USA Corp. (US) 2014-04-16 — — EP disclosed
US-8623589-B2 Bottom antireflective coating compositions and processes thereof AZ ELECTRONIC MATERIALS USA CORP. (US) 2014-01-07 — — US disclosed
WO-2012168785-A1 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AND PROCESSES THEREOF AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-12-13 — — WO disclosed
US-20120308939-A1 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AND PROCESSES THEREOF AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-12-06 — — US disclosed
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