SCHEMBL27685442

SCHEMBL27685442

O=C(Br)CCc1ccccc1Br

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.52
GPR52 Q9Y2T5 1/20 0.47
FFAR4 Q5NUL3 2/20 0.44
FFAR1 O14842 1/20 0.44
MAOB P27338 1/20 0.43
ALDH1A1 P00352 2/20 0.41
IDO1 P14902 2/20 0.41
KMT2A Q03164 2/20 0.40
RIPK1 Q13546 1/20 0.40
PARP10 Q53GL7 1/20 0.40
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL16669737 0.85 TAAR1 (0.54) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL30641923 0.83 FFAR1 (0.59) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL7573 0.83 FFAR1 (0.59) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL2962744 0.82 TAAR1 (0.50) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL7137459 0.82 IAPP (0.55) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL1613188 0.82 TAAR1 (0.55) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL1778391 0.80 CA12 (0.47) TAAR1GPR52ALDH1A1IDO1KMT2A
SCHEMBL14935427 0.80 IAPP (0.59) TAAR1GPR52FFAR4FFAR1MAOB
SCHEMBL22582004 0.80 HDAC2 (0.58) TAAR1GPR52MAOB
SCHEMBL23395750 0.79 GPR52 (0.55) TAAR1GPR52ALDH1A1KMT2AKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101593852-B Multibranched polymers and process for production thereof NIPPON SODA CO 2011-03-02 CN disclosed
CN-101593852-A Multibranched polymers and manufacture method thereof NIPPON SODA CO (JP) 2009-12-02 CN disclosed
CN-101001887-A Multi-branched polymer and method for producing same NIPPON SODA CO (JP) 2007-07-18 CN disclosed