SCHEMBL17844294

SCHEMBL17844294

S=C1CC=CC=C1C(=S)Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R38 P59533 3/20 0.43
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 3/20 0.41
HSD17B10 Q99714 3/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
MAPT P10636 5/20 0.41
CYP1A2 P05177 3/20 0.41
CYP2C9 P11712 3/20 0.41
CYP2C19 P33261 3/20 0.41
GAA P10253 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 3/20 0.40
KMT2A Q03164 6/20 0.39
CCR6 P51684 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 3/20 0.39
NOX1 Q9Y5S8 1/20 0.39
TP53 P04637 1/20 0.39
TYR P14679 1/20 0.39

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
SCHEMBL6555243 0.83 TAS2R38 (0.38) TAS2R38ALDH1A1CYP3A4HSD17B10NPC1
SCHEMBL4740303 0.78 ALDH1A1 (0.35) ALDH1A1NPC1RAB9AMAPTGAA
SCHEMBL5077456 0.76 ALDH1A1 (0.53) TAS2R38ALDH1A1CYP3A4HSD17B10NPC1
SCHEMBL4738754 0.76 KMT2A (0.39) ALDH1A1CYP3A4NPC1RAB9AMAPT
SCHEMBL5227550 0.75
SCHEMBL4741227 0.75 MAPT (0.47) ALDH1A1MAPTGAAKMT2ANPSR1
SCHEMBL9247348 0.74
SCHEMBL4736058 0.74 KDM4E (0.43) ALDH1A1RAB9AMAPTGAASMN1; SMN2
SCHEMBL7478487 0.70 ALDH1A1 (0.43) ALDH1A1CYP3A4HSD17B10NPC1RAB9A
SCHEMBL5691370 0.68 POLB (0.44) ALDH1A1HSD17B10NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10189960-B2 Rubber vibration damping material DOW GLOBAL TECHNOLOGIES LLC (US) 2019-01-29 US disclosed
EP-3233982-A1 IMPROVED RUBBER VIBRATION DAMPING MATERIAL Dow Global Technologies LLC (US) 2017-10-25 EP disclosed
US-20170283564-A1 IMPROVED RUBBER VIBRATION DAMPING MATERIAL DOW GLOBAL TECHNOLOGIES LLC 2017-10-05 US disclosed
WO-2016100059-A1 IMPROVED RUBBER VIBRATION DAMPING MATERIAL DOW GLOBAL TECHNOLOGIES LLC (US) 2016-06-23 WO disclosed