SCHEMBL4644792

SCHEMBL4644792

O=C(CCCl)C(=O)COCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 3/20 0.44
GRM5 P41594 4/20 0.43
CSNK1D P48730 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
PTPRC P08575 1/20 0.42
PTPN1 P18031 1/20 0.42
MAPT P10636 1/20 0.41
RAB9A P51151 2/20 0.41
NAMPT P43490 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CES2 O00748 1/20 0.39

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
SCHEMBL27620026 0.90 TSHR (0.44) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL4645623 0.89 TSHR (0.42) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL4645447 0.86 TSHR (0.50) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL27620037 0.84 TSHR (0.48) TSHRALDH1A1NPC1GRM5ADORA3
SCHEMBL27619966 0.82 ALDH1A1 (0.46) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL27620092 0.81 GRM5 (0.46) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL27601501 0.80 GRM5 (0.44) TSHRALDH1A1NPC1GRM5MAPT
SCHEMBL7272116 0.80 TSHR (0.56) TSHRALDH1A1NPC1GRM5PTPN1
SCHEMBL4642011 0.79 TSHR (0.50) TSHRALDH1A1NPC1GRM5CSNK1D
SCHEMBL4644484 0.78 HTT (0.37) TSHRALDH1A1NPC1GRM5MAPT

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-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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