SCHEMBL15979339

SCHEMBL15979339

C=C(CC(C)(C)CCCC)C(=O)OCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 2/20 0.36
FFAR1 O14842 1/20 0.36
CPT2 P23786 1/20 0.36
HCAR2 Q8TDS4 1/20 0.35
NAAA Q02083 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
RAD52 P43351 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ESR1 P03372 3/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
MAPK1 P28482 1/20 0.33
NR1H2 P55055 1/20 0.33
RNASEL Q05823 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
SCHEMBL16018848 0.95 TSHR (0.49) TSHRALDH1A1HPGDATMTDP1
SCHEMBL1225944 0.80 TSHR (0.46) TSHRALDH1A1HPGDATMTDP1
SCHEMBL9546001 0.79 TSHR (0.49) TSHRALDH1A1HPGDATMTDP1
SCHEMBL27560468 0.79 NAAA (0.47) TSHRALDH1A1HPGDATMTDP1
SCHEMBL29117751 0.78 TSHR (0.61) TSHRALDH1A1HCAR2NAAARAD52
SCHEMBL6049010 0.76 TSHR (0.42) TSHRALDH1A1HPGDATMTDP1
SCHEMBL375032 0.76 TSHR (0.57) TSHRALDH1A1HPGDATMTDP1
SCHEMBL3081526 0.74 TSHR (0.55) TSHRALDH1A1HPGDATMTDP1
SCHEMBL3477377 0.74 TSHR (0.55) TSHRALDH1A1HPGDATMTDP1
SCHEMBL198447 0.74 TSHR (0.55) TSHRALDH1A1HPGDATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9127102-B2 Thickening vinyl copolymers CONOPCO, INC. (US) 2015-09-08 US disclosed
US-20140243479-A1 THICKENING VINYL COPOLYMERS CONOPCO, INC., D/B/A UNILEVER (US) 2014-08-28 US disclosed