SCHEMBL3316934

SCHEMBL3316934

O=Nc1ccc(O)c(O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.48
PTGS1 P23219 2/20 0.48
POLB P06746 5/20 0.45
BLM P54132 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 3/20 0.45
HPGD P15428 2/20 0.45
ALOX15 P16050 2/20 0.45
MAPK1 P28482 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
ALPL P05186 2/20 0.44

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
SCHEMBL12228262 0.80 MAPT (0.40) PTGS2PTGS1POLBBLMKDM4E
SCHEMBL12206647 0.80 MAPT (0.58) POLBBLMKDM4EMEN1KMT2A
SCHEMBL798232 0.78 HSD17B10 (0.41) KDM4EMEN1KMT2AALDH1A1HSD17B10
SCHEMBL10208077 0.78 HSD17B10 (0.50) PTGS2PTGS1POLBBLMKDM4E
SCHEMBL11213671 0.78 PTGS1 (0.53) PTGS2PTGS1POLBMEN1KMT2A
SCHEMBL639211 0.78 RAB9A (0.52) KDM4EMEN1KMT2AALDH1A1HSD17B10
SCHEMBL13268128 0.78 ALDH1A1 (0.37) PTGS2PTGS1BLMKDM4EMEN1
SCHEMBL10208078 0.78 ALDH1A1 (0.37) PTGS2PTGS1BLMMEN1KMT2A
SCHEMBL21087428 0.78 TSHR (0.46) PTGS1KDM4EMEN1KMT2AALDH1A1
SCHEMBL18403872 0.78 ALOX15 (0.50) PTGS2PTGS1MEN1KMT2AALDH1A1

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
CN-108586474-A Simultaneously [2,3-b] indole derivatives and its preparation and application of benzo [5,6] [1,4] Dioxin 福州大学 2018-09-28 CN disclosed
EP-3257887-A1 POLYCARBONATE POLYOL COMPOSITIONS AND METHODS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-12-20 EP disclosed
US-7723444-B2 retarding the curing of the epoxy resin by adjusting an amount of the retarder while curing in presence of a curing accelerator cation phosphorus compound; used for semiconductor encapsulation; providing latency; storage stability; resist to soldering without forming cracks by the soldering SUMITOMO BAKELITE CO., LTD. (JP) 2010-05-25 US disclosed
US-7662979-B2 cyanation; dopamine autoreceptor agonists and partial agonists at postsynaptic dopamine D2 receptor; for treating dopaminergic disorders such as schizophrenia, schizoaffective disorder, Parkinson's disease, Tourette's syndrome, hyperprolactinemia, and drug addiction WYETH (US) 2010-02-16 US disclosed
US-20060189721-A1 retarding the curing of the epoxy resin by adjusting an amount of the retarder while curing in presence of a curing accelerator cation phosphorus compound; used for semiconductor encapsulation; providing latency; storage stability; resist to soldering without forming cracks by the soldering SUMITOMO BAKELITE CO., LTD. (JP) 2006-08-24 US disclosed
US-4011181-A POLYURETHANE FOAMS CONTAINING STANNOUS CATECHOL DERIVATIVES OLIN CORPORATION (US) 1977-03-08 US disclosed