SCHEMBL28176629

SCHEMBL28176629

CC(CCCCCCCC(=O)O)C(=O)OC1CC(C)(C)N(C)C(C)(C)C1.CN1C(C)(C)CC(OC(=O)CCCCCCCCC(=O)O)CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
FFAR1 O14842 1/20 0.37
NAAA Q02083 2/20 0.35
PTGER2 P43116 4/20 0.33
PTGER4 P35408 3/20 0.33
PTGER3 P43115 3/20 0.33
ALDH1A1 P00352 1/20 0.33
TBXA2R P21731 1/20 0.33
PTGFR P43088 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL573557 0.95 FFAR4 (0.40) FFAR4FFAR1PTGER2PTGER4PTGER3
SCHEMBL16790832 0.91 SMN1; SMN2 (0.40) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL846324 0.88 NAAA (0.43) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL14525068 0.86 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1MEN1GAAKMT2A
SCHEMBL27261571 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NAAAMEN1GAAKMT2A
SCHEMBL15686226 0.85 SMN1; SMN2 (0.40) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL19216018 0.84 SMN1; SMN2 (0.43) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL28480583 0.84 TSHR (0.49) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL13226047 0.82 NAAA (0.47) SMN1; SMN2NAAAALDH1A1MEN1GAA
SCHEMBL12244967 0.82 NAAA (0.47) SMN1; SMN2NAAAALDH1A1MEN1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107266893-A High reflectance makrolon 沙特基础全球技术有限公司 2017-10-20 CN disclosed
CN-104220502-B High-reflectivity polycarbonate 沙特基础全球技术有限公司 2017-08-25 CN disclosed