SCHEMBL28107285

SCHEMBL28107285

C=C(CCC)C(=O)OCCCCCCCCCCCCCCC

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.67
NAAA Q02083 1/20 0.52
RAD52 P43351 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
EPHX1 P07099 1/20 0.48
DGKA P23743 1/20 0.47
HTR2C P28335 1/20 0.46
HCAR2 Q8TDS4 1/20 0.44
FAAH O00519 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ACHE P22303 6/20 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
SCHEMBL3477492 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL28092117 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3478027 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3477532 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3628815 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL876115 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL28092116 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL7739780 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL236896 1.00 TSHR (0.67) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL3478058 0.98 TSHR (0.63) TSHRNAAARAD52NPSR1EPHX1

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