SCHEMBL15922307

SCHEMBL15922307

CCCCCCCCCCCCCCCCC1C2C=CC(C2)C1CC=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ADH1C P00326 2/20 0.33
ADH1A P07327 2/20 0.33
ADH4 P08319 2/20 0.33
EPHX1 P07099 2/20 0.33
ALOX5 P09917 1/20 0.33
ADH1B P00325 1/20 0.33
ADH7 P40394 1/20 0.33
ALDH1A1 P00352 4/20 0.32
FAAH O00519 2/20 0.32
TRPV1 Q8NER1 2/20 0.32
CTSK P43235 1/20 0.32
LMNA P02545 1/20 0.32
PPARG P37231 2/20 0.31
TBXA2R P21731 1/20 0.31
PTGFR P43088 1/20 0.31
PTGER2 P43116 1/20 0.31
DNTT P04053 1/20 0.31

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
SCHEMBL13346686 0.86
SCHEMBL7543239 0.86 ALDH1A1 (0.41) TSHREPHX1ALOX5ALDH1A1PPARG
SCHEMBL6237982 0.84 ALDH1A1 (0.38) TSHREPHX1ALOX5ALDH1A1CTSK
SCHEMBL13346698 0.81 HIF1A (0.32)
SCHEMBL13346701 0.80 ALDH1A1 (0.30) ALDH1A1
SCHEMBL13370545 0.78 ALDH1A1 (0.32) ALDH1A1
SCHEMBL23533343 0.78 TSHR (0.46) TSHRADH1CADH1AADH4EPHX1
SCHEMBL816628 0.78 CYP1A2 (0.36) ALDH1A1CTSKLMNA
SCHEMBL13346699 0.77
SCHEMBL11735435 0.74 GBA1 (0.39)

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
WO-2014120433-A1 PREPARATION OF BOTTLEBRUSH POLYMERS VIA RING-OPENING METATHESIS POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-08-07 WO disclosed