SCHEMBL8713355

SCHEMBL8713355

CCCc1ccc(C2c3c(C)cc(C)c(C)c3OC2(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.37
LIPG Q9Y5X9 1/20 0.37
CNR1 P21554 4/20 0.34
CNR2 P34972 4/20 0.34
TRPV6 Q9H1D0 2/20 0.31
TRPA1 O75762 1/20 0.31
HTR1A P08908 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
TRPV3 Q8NET8 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
TRPV5 Q9NQA5 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
TRPV2 Q9Y5S1 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL3896059 0.83 MAPT (0.30)
SCHEMBL8713361 0.82 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL4972258 0.81 ALOX5 (0.31)
SCHEMBL8717957 0.80 MEN1 (0.33)
SCHEMBL4970543 0.80 PGR (0.31)
SCHEMBL8716182 0.78 LMNA (0.31) TRPA1
SCHEMBL4969203 0.78 ALDH1A1 (0.37)
SCHEMBL8718722 0.77 LPL (0.32) LPLLIPG
SCHEMBL8715950 0.72 TSHR (0.35)
SCHEMBL27477557 0.70 NEK2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5770772-A 4-FORMYLAMINO-2,3,5-TRIMETHYL-1-(2-METHYL-2-PROPENYLOXY) -BENZENE; ARTERIOSCLEROSIS, BRAIN AND CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-23 US disclosed
US-5594154-A 5-AMINO-2-BROMOMETHYL-2,4,6,7-TETRAMETHYL-2,3-DIHYDROBENZO(B) FURANS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-14 US disclosed
US-5478844-A Method of using aminocoumaran derivatives for treating cerebrovascular diseases TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-12-26 US disclosed
EP-0483772-B1 Aminocoumaran derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-09-13 EP disclosed
US-5376681-A Aminocoumaran derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-27 US disclosed
EP-0483772-A1 Aminocoumaran derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-05-06 EP disclosed