SCHEMBL27639734

SCHEMBL27639734

CCCCC(C)NC(=O)C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
GAA P10253 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
ACACB O00763 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
EPHX1 P07099 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HPGD P15428 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL15961740 0.91 TP53 (0.49) NAAAGAATP53ACACBSMN1; SMN2
SCHEMBL27639742 0.90 GAA (0.51) NAAAGAACYP2C9CYP2C19LMNA
SCHEMBL15715059 0.88 GAA (0.49) NAAAGAACYP2C9CYP2C19LMNA
SCHEMBL24567736 0.82 GAA (0.61) NAAAGAACYP2C9CYP2C19LMNA
SCHEMBL10308293 0.82 GAA (0.61) NAAAGAACYP2C9CYP2C19LMNA
SCHEMBL27760996 0.82 NAAA (0.51) NAAAGAACYP2C9CYP2C19LMNA
SCHEMBL24568205 0.81 GAA (0.47) GAACYP2C9CYP2C19LMNASMN1; SMN2
SCHEMBL9829901 0.81 NAAA (0.50) NAAALMNATP53SMN1; SMN2
SCHEMBL9829904 0.81 NAAA (0.50) NAAALMNATP53SMN1; SMN2
SCHEMBL15961632 0.80 GAA (0.49) GAACYP2C9CYP2C19TP53ACACB

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-1867540-B Amides, polyolefin resin compositions, and moldings NEW JAPAN CHEM CO LTD 2010-05-26 CN disclosed
CN-1867540-A Amides, polyolefin resin compositions, and moldings NEW JAPAN CHEM CO LTD (JP) 2006-11-22 CN disclosed