SCHEMBL9929476

SCHEMBL9929476

C=C(CCCCCCCCC(C)C)C(=O)OCCCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
NAAA Q02083 1/20 0.42
DGKA P23743 1/20 0.42
MAPT P10636 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 2/20 0.40
EPHX1 P07099 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 0.39
HTR2C P28335 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38

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
SCHEMBL27962621 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL27855530 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL27989968 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL27646653 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL27626153 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL28016191 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL27989820 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL28365030 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL18815161 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52
SCHEMBL28234895 1.00 TSHR (0.54) TSHRNAAADGKAMAPTRAD52

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-9231138-B2 Method of producing barrier film exhibiting excellent gas barrier property, and barrier film Konica Minolta, Inc. (JP) 2016-01-05 US disclosed
US-20120153421-A1 BARRIER FILM AND PRODUCTION METHOD THEREOF KONICA MINOLTA HOLDINGS, INC. (JP) 2012-06-21 US disclosed