SCHEMBL3687802

SCHEMBL3687802

C=C(CC)C(=O)N(C)OCCCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TSHR P16473 3/20 0.36
HPGD P15428 2/20 0.36
ATM Q13315 1/20 0.34
NAAA Q02083 1/20 0.33
DNM1 Q05193 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
MCL1 Q07820 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8734465 0.83 ALDH1A1 (0.38) ALDH1A1TSHRHPGDATMNAAA
SCHEMBL238944 0.83 TSHR (0.43) ALDH1A1TSHRHPGDATMDNM1
SCHEMBL14717401 0.80 SOAT1 (0.31)
SCHEMBL15281943 0.76 ALDH1A1 (0.41) ALDH1A1TSHRHPGDATMNAAA
SCHEMBL11315083 0.76 ALDH1A1 (0.44) ALDH1A1TSHRHPGDATMNAAA
SCHEMBL2838639 0.76 TSHR (0.50) ALDH1A1TSHRHPGDATMDNM1
SCHEMBL18359032 0.74 ALDH1A1 (0.48) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL5159255 0.72 ALDH1A1 (0.41) ALDH1A1TSHRHPGDATMDNM1
SCHEMBL5158546 0.72 ALDH1A1 (0.41) ALDH1A1TSHRHPGDATMNAAA
Acrylic Acid SCHEMBL28247683 0.71 TSHR (0.46) ALDH1A1TSHRHPGDATMHCAR2

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
US-7795353-B2 Method for producing a modified propylene polymer SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-09-14 US disclosed
US-20080033076-A1 Olefin Polymer Composition Powder and Modified Olefin Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-02-07 US disclosed
US-20060148995-A1 Method for producing a modified propylene polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-06 US disclosed
EP-0930540-B1 PHOTOSENSITIVE COMPOSITION AND USE THEREOF SANYO CHEMICAL IND LTD (JP) 2004-06-16 EP disclosed
US-6727034-B1 HIGH SENSITIVITY AND HIGH RESOLUTION; BLACK MATRIX AND PHOSPHOR SCREEN FOR A COLOR PICTURE TUBE SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-27 US disclosed
EP-0930540-A1 PHOTOSENSITIVE COMPOSITION AND USE THEREOF SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-21 EP disclosed