SCHEMBL1421065

SCHEMBL1421065

C=Cc1ccc(CC)cc1.CCO[PH](=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRB P10828 1/20 0.36
MAOB P27338 2/20 0.36
IGF1R P08069 1/20 0.35
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
IDO1 P14902 2/20 0.33
MYC P01106 1/20 0.33

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
Styrene SCHEMBL28188466 0.82 ALDH1A1 (0.52) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
Phosphonic Acid SCHEMBL6329287 0.82 ALDH1A1 (0.44) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
SCHEMBL15915 0.81 ALDH1A1 (0.58) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
SCHEMBL28791085 0.79 CHRNB2 (0.41) ALDH1A1SMN1; SMN2CHRNB2CHRNB4CHRNA3
Ethylene SCHEMBL28003592 0.79 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
Arsenic SCHEMBL28835563 0.79 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
SCHEMBL1335766 0.78 ALDH1A1 (0.44) ALDH1A1MAPTLMNASMN1; SMN2CHRNB2
Dimethylamine SCHEMBL10633923 0.75 ALDH1A1 (0.50) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
SCHEMBL4526640 0.75 ALDH1A1 (0.50) ALDH1A1MAPTLMNAHPGDSMN1; SMN2
SCHEMBL6329293 0.75 ALDH1A1 (0.41) ALDH1A1THRBCHRNB2CHRNB4CHRNA3

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-104334474-A Low VOC aqueous coating compositions suitable for protecting metal-containing substrates including food and beverage packaging VALSPAR SOURCING INC 2015-02-04 CN disclosed
US-20140170428-A1 ADHESION TO METAL SURFACES WITH BLOCK COPOLYMERS OBTAINED USING RAFT DSM IP ASSETS B.V. (NL) 2014-06-19 US disclosed
US-20110159306-A1 ADHESION TO METAL SURFACES WITH BLOCK COPOLYMERS OBTAINED USING RAFT DSM IP ASSETS B.V. (NL) 2011-06-30 US disclosed
EP-2297259-A1 ADHESION TO METAL SURFACES WITH BLOCK COPOLYMERS OBTAINED USING RAFT DSM IP Assets B.V. (NL) 2011-03-23 EP disclosed
CN-101855010-A Colloidal dispersion of inorganic particles in a liquid phase comprising an amphiphilic copolymer RHODIA OPERATIONS 2010-10-06 CN disclosed
WO-2010000725-A1 ADHESION TO METAL SURFACES WITH BLOCK COPOLYMERS OBTAINED USING RAFT DSM IP ASSETS B.V. (NL) 2010-01-07 WO disclosed