SCHEMBL7918240

SCHEMBL7918240

O=CCOC(=O)CCC(=O)OCC=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
LMNA P02545 2/20 0.34
EGLN1 Q9GZT9 2/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DGKA P23743 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.30
ALKBH5 Q6P6C2 1/20 0.30
SUCNR1 Q9BXA5 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
SCHEMBL1346756 0.92 LMNA (0.45) TSHRADRA2AADRA1AMAPTBLM
SCHEMBL11507812 0.89 TSHR (0.50) TSHRMAPTLMNADGKACYP1A2
SCHEMBL22612006 0.88 TSHR (0.33) TSHRADRA2AADRA1AMAPTBLM
SCHEMBL14941138 0.86 TSHR (0.32) TSHRADRA2AADRA1AMAPTBLM
SCHEMBL1843295 0.85
SCHEMBL31249754 0.85
SCHEMBL15127515 0.84 KDM4E (0.50) TSHRADRA2AADRA1ALMNACYP1A2
Hydrochloric Acid SCHEMBL31249812 0.83 CYP1A2 (0.39) TSHRMAPTBLMLMNAPKM
Methyl Alcohol SCHEMBL27477393 0.83 ALDH1A1 (0.48) TSHRADRA2AADRA1AMAPTLMNA
SCHEMBL31249704 0.81 CYP1A2 (0.57) TSHRMAPTBLMLMNADGKA

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
CN-108586398-A A kind of preparation method of butane tetracarboxylic acid dianhydride 青岛科技大学 2018-09-28 CN disclosed
US-6181517-B1 Magnetic disc drive system with liquid film lubricating agent NEC CORPORATION (JP) 2001-01-30 US disclosed
US-6040031-A Contact recording magnetic disk device NEC CORPORATION (JP) 2000-03-21 US disclosed