SCHEMBL28304174

SCHEMBL28304174

CCCCCCCC(=O)C(CCCCCC)(C(N)=O)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 9/20 0.46
▸ CES1 P23141 9/20 0.46
▸ CES2 O00748 6/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAPK1 P28482 1/20 0.40

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
SCHEMBL10359003 0.79 FAAH (0.42) FAAHCES1CES2MEN1KMT2A
SCHEMBL31312418 0.77 FAAH (0.46) FAAHCES1CES2MEN1KMT2A
SCHEMBL29286444 0.74 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL21269257 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10
SCHEMBL21269295 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10
SCHEMBL21269294 0.73 CA1 (0.44) CES1CES2
SCHEMBL21269754 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10
SCHEMBL21269668 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10
SCHEMBL21269115 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10
SCHEMBL21269133 0.73 CES2 (0.41) CES2MEN1KMT2AHSD17B10

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-110317107-A A kind of secondary nutrients 武汉市沃农肥业有限公司 2019-10-11 — — CN disclosed
CN-109972428-A A kind of dyeing of heavy twist woven dacron 浙江紫竹梅印染有限公司 2019-07-05 — — CN disclosed
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