SCHEMBL28073013

SCHEMBL28073013

O=C(O)CCCCCCC(CCCCCCCCCCCCCCC(CCCC(CCC(=O)O)C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 15/20 0.71
LMNA P02545 1/20 0.52
TSHR P16473 1/20 0.52
NFKB1 P19838 1/20 0.52
PMP22 Q01453 1/20 0.52
GSTK1 Q9Y2Q3 1/20 0.48
GRM3 Q14832 1/20 0.48

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
SCHEMBL4627760 0.98 FOLH1 (0.74) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL28580432 0.98 FOLH1 (0.74) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL28580433 0.98 FOLH1 (0.74) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL17867254 0.98 FOLH1 (0.74) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL28267581 0.96 FOLH1 (0.73) FOLH1LMNAGRM3
SCHEMBL8639831 0.93 FOLH1 (0.67) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL10348904 0.93 FOLH1 (0.80) FOLH1GRM3
SCHEMBL11769103 0.93 FOLH1 (0.67) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL1234699 0.93 FOLH1 (0.67) FOLH1LMNATSHRNFKB1PMP22
SCHEMBL30681842 0.93 FOLH1 (0.67) FOLH1LMNATSHRNFKB1PMP22

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-102272100-B Technetium-and rhenium-bis (heteroaryl) complexes for inhibition of PSMA and methods of use thereof 分子制药洞察公司 2016-08-17 CN disclosed