SCHEMBL123739

SCHEMBL123739

CCCCC(c1ccccc1)[n+]1cccc(C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
PRSS1 P07477 1/20 0.36
CTSG P08311 1/20 0.36
CTRB1 P17538 1/20 0.36
CMA1 P23946 1/20 0.36
CNR2 P34972 1/20 0.36
NAAA Q02083 1/20 0.35

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
SCHEMBL123117 0.92 KMT2A (0.41) MEN1KMT2AALDH1A1HTTL3MBTL1
SCHEMBL123905 0.86 KMT2A (0.44) POLBMEN1KMT2AALDH1A1HTT
SCHEMBL124518 0.85 POLB (0.43) POLBALDH1A1CES2CES1CYP3A4
SCHEMBL14802083 0.79 POLB (0.41) POLBALDH1A1
Bromide SCHEMBL10456974 0.78 POLB (0.40) POLBKMT2AALDH1A1HTTTSHR
SCHEMBL124805 0.76 ALDH1A1 (0.41) POLBALDH1A1TSHR
SCHEMBL125795 0.75 MEN1 (0.47) POLBMEN1KMT2AALDH1A1HTT
Benzoic Acid SCHEMBL871900 0.75 TSHR (0.50) POLBALDH1A1CES2CES1CYP1A2
SCHEMBL125472 0.72 POLB (0.43) POLBMEN1KMT2AALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL1072631 0.72 MEN1 (0.42) MEN1KMT2A

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
EP-2143820-B1 An electroless gold plating solution ROHM & HAAS ELECT MAT (US) 2012-03-07 EP disclosed
EP-2143820-A1 An electroless gold plating solution Rohm and Haas Electronic Materials LLC (US) 2010-01-13 EP disclosed
US-7534289-B1 Electroless gold plating solution ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2009-05-19 US disclosed