SCHEMBL28107609

SCHEMBL28107609

CC=C(CCCCCC)C(=O)OCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
NAAA Q02083 1/20 0.50
DGKA P23743 1/20 0.50
HCAR2 Q8TDS4 2/20 0.47
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47
DNM1 Q05193 1/20 0.46
HTR2C P28335 1/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
FAAH O00519 2/20 0.44
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43

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
SCHEMBL28107624 1.00 TSHR (0.55) TSHRNAAADGKAHCAR2RAD52
SCHEMBL28010253 1.00 TSHR (0.55) TSHRNAAADGKAHCAR2RAD52
SCHEMBL997356 1.00 TSHR (0.55) TSHRNAAADGKAHCAR2RAD52
SCHEMBL27827317 1.00 TSHR (0.55) TSHRNAAADGKAHCAR2RAD52
SCHEMBL27737078 0.96 TSHR (0.50) TSHRNAAADGKAHCAR2RAD52
SCHEMBL28107615 0.96 TSHR (0.50) TSHRNAAADGKAHCAR2RAD52
SCHEMBL28115131 0.96 TSHR (0.55) TSHRNAAADGKAHCAR2RAD52
SCHEMBL998617 0.89 ATM (0.50) TSHRNAAADGKAHCAR2RAD52
SCHEMBL21496337 0.87 TSHR (0.53) TSHRNAAADGKAHCAR2RAD52
SCHEMBL2228697 0.87 NAAA (0.57) TSHRNAAADGKAHCAR2RAD52

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
CN-106119443-B The grease proofing antifouling care agent of aerosol type surface waterproofing 崔晓雪 2018-08-21 CN disclosed
CN-106119443-A The grease proofing antifouling nursing agent of aerosol type surface waterproofing 崔晓雪 2016-11-16 CN disclosed