SCHEMBL28108367

SCHEMBL28108367

CCCCCCC(C)C=C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
OPRM1 P35372 1/20 0.34
SPHK1 Q9NYA1 1/20 0.33
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
DNM1 Q05193 2/20 0.31
CYP2D6 P10635 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
TRPA1 O75762 1/20 0.31
DDAH1 O94760 1/20 0.31
GAPDH P04406 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.30

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
SCHEMBL4432101 0.79 LMNA (0.31) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9699827 0.75 SLC2A1 (0.31)
SCHEMBL6902527 0.73 ADH1B (0.35) ADH1BADH1CADH1AADH4ADH7
SCHEMBL6902528 0.73 ADH1B (0.35) ADH1BADH1CADH1AADH4ADH7
SCHEMBL2783831 0.72 TSHR (0.45)
SCHEMBL28030710 0.71 OPRM1 (0.38) ADH1BADH1CADH1AADH4ADH7
SCHEMBL6902310 0.69 TSHR (0.47)
SCHEMBL24361945 0.69 GABRP (0.39) MAPTLMNACYP2D6
SCHEMBL14564167 0.69 OPRM1 (0.44) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9801267 0.68 CCR5 (0.40)

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-106459319-A A photocurable sealing agent composition, its preparation and its use 亨斯迈先进材料(瑞士)有限公司 2017-02-22 CN disclosed