SCHEMBL28301810

SCHEMBL28301810

COC(=O)CCCCCCC(C)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
LMNA P02545 4/20 0.50
ALDH1A1 P00352 2/20 0.50
PABPC1 P11940 1/20 0.48
APOBEC3A P31941 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
MAPT P10636 1/20 0.47
PPARG P37231 2/20 0.44
KMT2A Q03164 1/20 0.42
PPARA Q07869 1/20 0.42
RECQL P46063 1/20 0.41
EPHX2 P34913 1/20 0.39

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
SCHEMBL17883542 1.00 TSHR (0.56) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL15216418 1.00 TSHR (0.56) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL15994316 1.00 TSHR (0.56) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL4530697 0.98 TSHR (0.58) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL16668510 0.98 TSHR (0.58) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL4958389 0.91 TSHR (0.61) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL27274544 0.91 TSHR (0.61) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL17883546 0.89 ALDH1A1 (0.54) TSHRL3MBTL1LMNAALDH1A1MAPT
SCHEMBL17883545 0.89 ALDH1A1 (0.54) TSHRL3MBTL1LMNAALDH1A1MAPT
SCHEMBL19331760 0.86 ALDH1A1 (0.54) TSHRL3MBTL1LMNAALDH1A1MAPT

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-109942414-A High temperature resistant super-pressure dicarboxylic acid for electrolyte and its preparation method and application 武汉海斯普林科技发展有限公司 2019-06-28 CN disclosed