SCHEMBL8735555

SCHEMBL8735555

C=CC(CCCCCC)N(C=O)C(C=C)CCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 3/20 0.40
ADH1A P07327 3/20 0.40
ADH4 P08319 3/20 0.40
ADH1B P00325 2/20 0.40
ADH7 P40394 2/20 0.40
TSHR P16473 2/20 0.35
MAPT P10636 2/20 0.35
TRPA1 O75762 1/20 0.35
DDAH1 O94760 1/20 0.35
GAPDH P04406 1/20 0.35
GPR84 Q9NQS5 4/20 0.34
FDPS P14324 3/20 0.34
FFAR1 O14842 1/20 0.34
EPHX1 P07099 1/20 0.33
LMNA P02545 1/20 0.33
LCK P06239 1/20 0.33
PPARD Q03181 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
PLA2G1B P04054 1/20 0.32

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
SCHEMBL8733682 0.92 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL9418798 0.80 ADH1C (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL27521083 0.78 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL28051178 0.78 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL28146531 0.78 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL27585313 0.78 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL9418808 0.77 ADH1C (0.39) ADH1CADH1AADH4ADH1BADH7
Hydrochloric Acid SCHEMBL27395700 0.76 DNM1 (0.38) ADH1CADH1AADH4ADH1BADH7
Hydrochloric Acid SCHEMBL28284653 0.76 DNM1 (0.38) ADH1CADH1AADH4ADH1BADH7
Hydrochloric Acid SCHEMBL11148457 0.76 DNM1 (0.38) ADH1CADH1AADH4ADH1BADH7

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
EP-0825206-A1 Thermoplastic resin composition and compatibilizing agent used therein DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1998-02-25 EP disclosed