SCHEMBL2339823

SCHEMBL2339823

O=C(CSc1ccc(O)cc1)Nc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.74
POLB P06746 4/20 0.74
PPARG P37231 1/20 0.74
NCOA2 Q15596 1/20 0.74
NCOA1 Q15788 1/20 0.74
NCOA3 Q9Y6Q9 1/20 0.74
HSD17B10 Q99714 3/20 0.65
ALDH1A1 P00352 3/20 0.65
HTT P42858 2/20 0.65
LMNA P02545 2/20 0.65
MEN1 O00255 4/20 0.62
USP2 O75604 1/20 0.62
MAPT P10636 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MAPK1 P28482 1/20 0.59
RAB9A P51151 3/20 0.58
TSHR P16473 2/20 0.58
NPC1 O15118 2/20 0.58
PKM P14618 1/20 0.58

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
SCHEMBL930576 0.91 KMT2A (0.71) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL6796256 0.90 ALDH1A1 (0.78) KMT2APOLBPPARGNCOA2NCOA1
Ammonia Solution, Strong SCHEMBL28437729 0.88 ALDH1A1 (0.76) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL3627574 0.86 KMT2A (0.68) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL9617162 0.82 L3MBTL1 (0.84) KMT2APOLBHSD17B10MEN1USP2
SCHEMBL28442353 0.82 ALDH1A1 (0.88) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL28437500 0.81 ALDH1A1 (0.58) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL931193 0.81 KMT2A (0.61) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL29381166 0.81 KMT2A (0.61) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL5222352 0.80 KMT2A (0.64) KMT2APOLBPPARGNCOA2NCOA1

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-1967514-B1 Phenolic compounds and recording materials containing the same NIPPON SODA CO (JP) 2013-01-02 EP disclosed
EP-1219598-B1 PHENOLIC COMPOUNDS AND RECORDING MATERIALS CONTAINING THE SAME NIPPON SODA CO (JP) 2011-08-31 EP disclosed
EP-1967514-A1 Phenolic compounds and recording materials containing the same Nippon Soda Co., Ltd. (JP) 2008-09-10 EP disclosed
US-7012159-B1 Phenolic compounds and recording materials containing the same NIPPON SODA CO., LTD. (JP) 2006-03-14 US disclosed
EP-1219598-A1 PHENOLIC COMPOUNDS AND RECORDING MATERIALS CONTAINING THE SAME NIPPON SODA CO., LTD. (JP) 2002-07-03 EP disclosed