SCHEMBL29284385

SCHEMBL29284385

C=CC(=CCCCC)CCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
ALDH1A1 P00352 2/20 0.41
EP300 Q09472 1/20 0.39
FAAH O00519 3/20 0.39
TERT O14746 3/20 0.38
PTPN1 P18031 3/20 0.38
PPARG P37231 3/20 0.38
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
CYP1A2 P05177 2/20 0.38
MAPT P10636 2/20 0.38
CYP2C19 P33261 2/20 0.38
BLM P54132 2/20 0.38
HSD17B10 Q99714 2/20 0.38
FABP4 P15090 2/20 0.38
F7 P08709 2/20 0.38
F3 P13726 2/20 0.38
KMT2A Q03164 2/20 0.38
GMNN O75496 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL29284373 1.00 TSHR (0.43) TSHRALDH1A1EP300FAAHTERT
SCHEMBL29284448 0.96 TSHR (0.48) TSHREP300FAAHTERTPTPN1
SCHEMBL29284258 0.92 TSHR (0.48) TSHREP300FAAHTERTPTPN1
SCHEMBL108398 0.91 TSHR (0.44) TSHRALDH1A1EP300F7F3
SCHEMBL11601333 0.91 TSHR (0.44) TSHRALDH1A1EP300F7F3
SCHEMBL108399 0.91 TSHR (0.44) TSHRALDH1A1EP300F7F3
SCHEMBL29284509 0.85 TSHR (0.41) TSHRALDH1A1FAAHPTPN1PPARG
SCHEMBL2879170 0.84 TSHR (0.39) TSHRALDH1A1KMT2AMEN1TP53
SCHEMBL2879171 0.84 TSHR (0.39) TSHRALDH1A1KMT2AMEN1TP53
SCHEMBL8430984 0.83 TSHR (0.39) TSHRALDH1A1TP53CES2CES1

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-118201905-A Cationic lipid 武田药品工业株式会社 2024-06-14 CN disclosed