SCHEMBL8414633

SCHEMBL8414633

C=C(C)C(=O)OC(CCCCC)CC(CC)CCCC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
CYP3A4 P08684 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
ATM Q13315 1/20 0.39
CA2 P00918 3/20 0.38
ALDH1A1 P00352 4/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 2/20 0.33
PRKCA P17252 1/20 0.33
PRKCD Q05655 1/20 0.33
FAAH O00519 1/20 0.33
RECQL P46063 1/20 0.33
CTSK P43235 1/20 0.33

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
SCHEMBL29362752 0.99 TSHR (0.44) TSHRCYP3A4TDP1ATMCA2
SCHEMBL11057143 0.97 TSHR (0.45) TSHRCYP3A4TDP1ATMCA2
SCHEMBL29540667 0.93 TSHR (0.41) TSHRCYP3A4TDP1ATMCA2
SCHEMBL27697659 0.88 ALDH1A1 (0.44) TSHRCYP3A4TDP1ATMCA2
SCHEMBL1493259 0.86 TSHR (0.50) TSHRCA2ALDH1A1PRKCAPRKCD
SCHEMBL10528809 0.84 TSHR (0.53) TSHRCA2LMNAFAAH
SCHEMBL15668604 0.84 TSHR (0.53) TSHRCA2LMNAFAAH
SCHEMBL866130 0.84 TSHR (0.53) TSHRCA2LMNAFAAH
SCHEMBL154112 0.84 TSHR (0.49) TSHRPRKCAPRKCDFAAHCTSK
SCHEMBL13505835 0.84 TSHR (0.53) TSHRCA2LMNAFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614113-B1 Silver halide photographic photosensitive material MITSUBISHI PAPER MILLS LTD (JP) 1999-08-11 EP disclosed
US-5482815-A Silver halide photographic photosensitive material MITSUBISHI PAPER MILLS LIMITED (JP) 1996-01-09 US disclosed
EP-0614113-A2 Silver halide photographic photosensitive material MITSUBISHI PAPER MILLS, LTD. (JP) 1994-09-07 EP disclosed