SCHEMBL4642200

SCHEMBL4642200

CC(=O)OC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 6/20 0.64
MAPK1 P28482 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
CES1 P23141 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP1A2 P05177 2/20 0.39
ALOX15 P16050 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 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
Phosphine SCHEMBL27280289 0.98 KCNN4 (0.62) KCNN4MAPK1MAPTKMT2ANPSR1
SCHEMBL28848759 0.98 KCNN4 (0.62) KCNN4MAPK1MAPTKMT2ANPSR1
SCHEMBL7587514 0.87 KCNN4 (0.68) KCNN4MAPTKMT2ANPSR1CES1
SCHEMBL2235170 0.82 MAPT (0.53) KCNN4MAPK1MAPTKMT2ACES1
SCHEMBL6469118 0.82 CHRM3 (0.47) KCNN4MAPTKMT2AALDH1A1CYP2C19
SCHEMBL4641850 0.80 CYP1A2 (0.55) KCNN4MAPK1MAPTKMT2ACES1
SCHEMBL9676566 0.80 KCNN4 (0.46) KCNN4MAPK1MAPTKMT2ACES1
SCHEMBL11395708 0.80 KCNN4 (0.46) KCNN4MAPK1MAPTKMT2ACES1
SCHEMBL23798386 0.79 KCNN4 (0.59) KCNN4MAPTKMT2ANPSR1CES1
SCHEMBL4642195 0.79 KCNN4 (0.59) KCNN4MAPTKMT2ANPSR1CES1

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
CN-106832224-A The hardener composition of epoxy resin 蓝立方知识产权有限责任公司 2017-06-13 CN disclosed
CN-106045841-A Method for preparing trisubstituted carboxylic acid compounds 湖北华世通生物医药科技有限公司 2016-10-26 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed