SCHEMBL28783402

SCHEMBL28783402

O=C(O)CCCCC(O)Cl

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
NFKB1 P19838 2/20 0.52
TSHR P16473 1/20 0.52
PMP22 Q01453 1/20 0.52
FFAR4 Q5NUL3 2/20 0.52
FFAR1 O14842 2/20 0.52
GSTK1 Q9Y2Q3 2/20 0.50
ENPEP Q07075 1/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
ALDH1A1 P00352 1/20 0.45
GPR84 Q9NQS5 1/20 0.44
AKR1B1 P15121 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL27768874 1.00 LMNA (0.55) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL27907123 1.00 LMNA (0.55) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL8894698 0.98 LMNA (0.57) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL28574666 0.98 LMNA (0.57) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL10354453 0.92
Adipic Acid SCHEMBL1147325 0.86 LMNA (0.50) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL6913774 0.81
SCHEMBL3755409 0.81
SCHEMBL7408621 0.80 TSHR (0.60) LMNANFKB1TSHRPMP22FFAR4
SCHEMBL7928649 0.80 TSHR (0.60) LMNANFKB1TSHRPMP22FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101724670-B Method for co-production of chiral hydroxy ester from uridine phosphinylidyne compounds NANJING TECH UNIVERSITY (CN) 2012-02-01 CN disclosed
CN-101693684-B Method for preparing 4-hydroxylethylpyrrolidone-2-acetamide SUZHOU HAOBO SCIENCE AND TECHNOLOGY CO LTD 2011-08-24 CN disclosed
CN-101724670-A Method for co-production of chiral hydroxy ester from uridine phosphinylidyne compounds NANJING UNIVERSITY OF TECHNOLOGY 2010-06-09 CN disclosed
CN-101693684-A Method for preparing 4-hydroxylethylpyrrolidone-2-acetamide SUZHOU HAOBO SCIENCE AND TECHN 2010-04-14 CN disclosed