SCHEMBL28117633

SCHEMBL28117633

CCCCCCCCCCCCOC(=O)C(C)=COC(=O)/C=C\C(=O)OC=C(C)C(=O)OCCCCCCCCCCCC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.54
TSHR P16473 2/20 0.53
ATM Q13315 1/20 0.50
NAAA Q02083 1/20 0.44
NPSR1 Q6W5P4 2/20 0.42
RAD52 P43351 1/20 0.42
EPHX1 P07099 1/20 0.42
FAAH O00519 1/20 0.41
ACHE P22303 6/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL22572644 0.88 TSHR (0.54) HCAR2TSHRATMNAAANPSR1
SCHEMBL28116365 0.88 TSHR (0.54) HCAR2TSHRATMNAAANPSR1
SCHEMBL22042871 0.88 TSHR (0.54) HCAR2TSHRATMNAAANPSR1
SCHEMBL22572577 0.88 TSHR (0.54) HCAR2TSHRATMNAAANPSR1
SCHEMBL28193229 0.86 HCAR2 (0.48) HCAR2TSHRATMNPSR1ALDH1A1
SCHEMBL20530994 0.83 TSHR (0.70) HCAR2TSHRNAAANPSR1RAD52
SCHEMBL27974228 0.83 TSHR (0.70) HCAR2TSHRNAAANPSR1RAD52
SCHEMBL3794445 0.81 TSHR (0.58) HCAR2TSHRATMNAAANPSR1
SCHEMBL2944725 0.81 TSHR (0.58) HCAR2TSHRATMNAAANPSR1
SCHEMBL28175610 0.80 TSHR (0.56) HCAR2TSHRATMNAAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105062164-B A kind of aqueous wear-resistant coating, aqueous wear-resistant thin film and its preparation method and application 广州市金万正印刷材料有限公司 2016-12-21 CN disclosed