SCHEMBL8439675

SCHEMBL8439675

C=CC(O)c1ccccc1I

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
KCNH2 Q12809 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
SCHEMBL7594286 0.84 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL5189721 0.78 CYP3A4 (0.32) CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL15066652 0.78 CYP3A4 (0.35) CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL15388937 0.77 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL11606150 0.76 CYP3A4 (0.44) ALDH1A1TSHRCYP3A4CYP2D6SLC6A2
SCHEMBL9815785 0.76 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL9555419 0.76 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL387118 0.76 GABRA1 (0.48) ALDH1A1TSHRCYP3A4
SCHEMBL5614870 0.76 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL526123 0.76 ALDH1A1 (0.48) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105385044-B A kind of automobile safe airbag lid material TPV and preparation method thereof 嘉兴市博尔塑胶有限公司 2018-05-22 CN claimed
CN-105385044-A TPV (Thermoplastic Vulcanizate) for automobile safety airbag cover material and preparation method for TPV Jiaxing boer plastic co ltd 2016-03-09 CN claimed
CN-105385044-B A kind of automobile safe airbag lid material TPV and preparation method thereof 嘉兴市博尔塑胶有限公司 2018-05-22 CN disclosed
CN-105385044-A TPV (Thermoplastic Vulcanizate) for automobile safety airbag cover material and preparation method for TPV Jiaxing boer plastic co ltd 2016-03-09 CN disclosed
US-5910554-A Highly cross-linked polymeric supports REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1999-06-08 US disclosed