SCHEMBL4887795

SCHEMBL4887795

C=C(C)C(=O)OCC(C)(CC)CC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.47
TSHR P16473 4/20 0.46
ALDH1A1 P00352 4/20 0.40
LMNA P02545 2/20 0.38
HSD17B10 Q99714 2/20 0.38
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL8850603 0.96 THRB (0.47) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL9566721 0.90 THRB (0.43) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL51592 0.89 TSHR (0.50) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL23494069 0.89 LMNA (0.50) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL16328321 0.87 THRB (0.41) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL9568685 0.86 THRB (0.43) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL27722849 0.85 THRB (0.42) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL8851353 0.84 LMNA (0.58) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL10802310 0.83 THRB (0.41) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL65529 0.83 TSHR (0.45) THRBTSHRALDH1A1LMNAHSD17B10

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-8648160-B2 Optical semiconductor sealing material IDEMITSU KOSAN CO., LTD. (JP) 2014-02-11 US claimed
US-8648160-B2 Optical semiconductor sealing material IDEMITSU KOSAN CO., LTD. (JP) 2014-02-11 US disclosed
US-20120305982-A1 OPTICAL SEMICONDUCTOR SEALING MATERIAL IDEMITSU KOSAN CO., LTD. (JP) 2012-12-06 US disclosed
CN-101056900-B Optical semiconductor sealing material IDEMITSU KOSAN CO 2011-09-07 CN disclosed
US-20080097072-A1 Optical Semiconductor Sealing Material IDEMITSU KOSAN CO., LTD. (JP) 2008-04-24 US disclosed
CN-101056900-A Optical semiconductor sealing material IDEMITSU KOSAN CO (JP) 2007-10-17 CN disclosed