SCHEMBL4748334

SCHEMBL4748334

COC(=O)C(O)CCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
ALDH1A1 P00352 2/20 0.42
TET2 Q6N021 3/20 0.41
KDM4A O75164 2/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM2A Q9Y2K7 2/20 0.41
TET3 O43151 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
FFAR1 O14842 1/20 0.41
LMNA P02545 2/20 0.40
SLC22A6 Q4U2R8 2/20 0.40
ENPEP Q07075 2/20 0.39
GSTK1 Q9Y2Q3 2/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
AKR1B1 P15121 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.37
GPR84 Q9NQS5 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
SCHEMBL2409644 0.87 TET2 (0.56) TSHRTET2KDM4AKDM4CKDM2A
SCHEMBL10425792 0.83 TSHR (0.56) TSHRALDH1A1LMNACA1CA2
SCHEMBL27447240 0.81 ENPEP (0.34) TSHRALDH1A1TET2KDM4AKDM4C
SCHEMBL27730935 0.80 FFAR4 (0.39) TSHRTET2KDM4AKDM4CKDM2A
SCHEMBL9794608 0.79 TSHR (0.48) TSHRALDH1A1LMNASLC22A6ENPEP
SCHEMBL710385 0.79 TSHR (0.48) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL27730932 0.79 CYP1A2 (0.50) TSHRALDH1A1CA1CA2
SCHEMBL29253175 0.78 CA1 (0.41) TSHRFFAR1CA1CA2GPR84
SCHEMBL7947554 0.78 CA2 (0.61) TSHRFFAR1LMNACA1CA2
SCHEMBL149523 0.78 CA2 (0.61) TSHRFFAR1LMNACA1CA2

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
WO-2008113190-A1 METHOD FOR THE PRODUCTION OF R-HYDROXYCARBOXYLIC ACIDS EMPA EIDGENÖSSISCHE MATERIALPRÜFUNGS- UND FORSCHUNGSANSTALT (CH) 2008-09-25 WO claimed