SCHEMBL23074409

SCHEMBL23074409

COC(=O)CCCCCCCCOC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
LMNA P02545 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 1/20 0.45
RECQL P46063 1/20 0.44
DGKA P23743 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX2 P34913 2/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PPARG P37231 1/20 0.38
LTB4R Q15722 1/20 0.38
HPGD P15428 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL14769788 0.84 EPHX2 (0.42) TSHRLMNAALDH1A1DGKAEPHX2
SCHEMBL13010550 0.84 DGKA (0.53) TSHRLMNAALDH1A1DGKAEPHX2
SCHEMBL13010547 0.84 DGKA (0.53) TSHRLMNAALDH1A1DGKAEPHX2
SCHEMBL14427294 0.84 TSHR (0.45) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL2075717 0.83 TSHR (0.55) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL4309611 0.83 ALDH1A1 (0.53) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL4309608 0.83 ALDH1A1 (0.53) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL13010559 0.82 DGKA (0.52) TSHRDGKAEPHX2
SCHEMBL31049827 0.82 TSHR (0.52) TSHRLMNAALDH1A1KMT2ARECQL
Hydrochloric Acid SCHEMBL27853842 0.81 TSHR (0.52) TSHRLMNAALDH1A1KMT2ARECQL

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
EP-3361521-B1 LIGHT-EMITTING ELEMENT SUMITOMO CHEMICAL CO (JP) 2021-03-10 EP disclosed