SCHEMBL29790337

SCHEMBL29790337

CCOCCOCCOCCOCCOCC(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
ALDH1A1 P00352 3/20 0.46
THRB P10828 1/20 0.41
MGAM O43451 2/20 0.37
GAA P10253 2/20 0.37
SI P14410 2/20 0.37
MGAM2 Q2M2H8 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.36
EPHX2 P34913 1/20 0.35
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
CES2 O00748 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
SCHEMBL5331962 0.98 TSHR (0.48) TSHRALDH1A1THRBMGAMGAA
SCHEMBL7648165 0.91 TSHR (0.48) TSHRMGAMGAASIMGAM2
SCHEMBL6463788 0.88 TSHR (0.50) TSHRALDH1A1MGAMGAASI
SCHEMBL26700384 0.86 TSHR (0.40) TSHRALDH1A1MGAMGAASI
SCHEMBL16448991 0.86 TSHR (0.40) TSHRALDH1A1MGAMGAASI
SCHEMBL12015626 0.86 TSHR (0.40) TSHRALDH1A1MGAMGAASI
SCHEMBL195069 0.85
SCHEMBL5049754 0.84 TSHR (0.42) TSHRALDH1A1MGAMGAASI
SCHEMBL31672720 0.84 TSHR (0.42) TSHRALDH1A1MGAMGAASI
SCHEMBL30179205 0.84 TSHR (0.42) TSHRALDH1A1MGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114787159-A BRM targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2022-07-22 CN disclosed