SCHEMBL10953000

SCHEMBL10953000

OCc1ccc(Cc2cccs2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.43
PTGS1 P23219 2/20 0.43
PTGS2 P35354 2/20 0.43
TAAR1 Q96RJ0 1/20 0.42
LTA4H P09960 2/20 0.42
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
CYP2C19 P33261 1/20 0.41
CYP2C9 P11712 1/20 0.41
FYN P06241 1/20 0.41
TSHR P16473 1/20 0.41
ADRA1D P25100 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DPP4 P27487 1/20 0.39
POLB P06746 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
SCHEMBL10525378 0.83 L3MBTL1 (0.55) PTGS1PTGS2TAAR1LTA4HADRA2A
SCHEMBL45228 0.80 LMNA (0.50) HPGDPTGS1PTGS2TAAR1CYP2C19
SCHEMBL3385419 0.79 MEN1 (0.54) HPGDTRPM8PTGS1PTGS2TAAR1
SCHEMBL11660485 0.79 TAAR1 (0.42) PTGS1PTGS2TAAR1LTA4HADRA2A
SCHEMBL29337530 0.79 LTA4H (0.57) PTGS1PTGS2TAAR1LTA4HADRA2A
SCHEMBL3238290 0.79 LMNA (0.62) HPGDPTGS1PTGS2TAAR1ADRA1D
SCHEMBL7294757 0.79 CYP3A4 (0.52) HPGDPTGS1PTGS2TAAR1LTA4H
Methyl Alcohol SCHEMBL5311361 0.79 LMNA (0.50) HPGDPTGS1PTGS2TAAR1LTA4H
SCHEMBL20738474 0.79 MEN1 (0.61) HPGDTRPM8PTGS1PTGS2TAAR1
SCHEMBL923302 0.79 MEN1 (0.53) HPGDTAAR1CYP2C19CYP2C9TSHR

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-4556409-A CONTROLLING SOYBEAN GROWTH EMERY INDUSTRIES INC. (US) 1985-12-03 US disclosed
US-4522749-A Process for augmenting or enhancing the aroma of a fragrance by adding a vinylcyclopropane compound NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1985-06-11 US disclosed
US-4418202-A HERBICIDES, PESTICIDES EMERY INDUSTRIES, INC. (US) 1983-11-29 US disclosed
US-4380656-A PESTICIDES, HERBICIDES EMERY INDUSTRIES, INC. (US) 1983-04-19 US disclosed