SCHEMBL28517232

SCHEMBL28517232

CCCCCCCCCCCCCCCC(=O)NC(COCc1ccccc1)C(=O)OCCCCCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NOD1 Q9Y239 1/20 0.49
EPHX2 P34913 1/20 0.48
LPAR1 Q92633 2/20 0.48
LPAR3 Q9UBY5 2/20 0.48
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47

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
SCHEMBL28517231 1.00 FAAH (0.50) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL28526224 0.88 FAAH (0.60) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL28526228 0.88 FAAH (0.60) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL8665523 0.86 FAAH (0.63) FAAHNOD1ITGB3ITGA2B
SCHEMBL11783496 0.86 FAAH (0.63) FAAHNOD1ITGB3ITGA2B
SCHEMBL5696302 0.86 FAAH (0.63) FAAHNOD1ITGB3ITGA2B
SCHEMBL28514511 0.85 FAAH (0.47) FAAHMEN1KMT2AEPHX2LPAR1
SCHEMBL28514512 0.83 FAAH (0.54) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL8823462 0.81 MEN1 (0.54) FAAHMEN1KMT2AEPHX2
SCHEMBL9390499 0.81 MEN1 (0.54) FAAHMEN1KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112341354-B PMS synthesis method 湖北泓肽生物科技有限公司 2022-06-10 CN claimed
CN-112341354-A PMS synthesis method 湖北泓肽生物科技有限公司 2021-02-09 CN claimed
CN-112341354-B PMS synthesis method 湖北泓肽生物科技有限公司 2022-06-10 CN disclosed
CN-112341354-B PMS synthesis method 湖北泓肽生物科技有限公司 2022-06-10 CN disclosed
CN-112341354-A PMS synthesis method 湖北泓肽生物科技有限公司 2021-02-09 CN disclosed
CN-112341354-A PMS synthesis method 湖北泓肽生物科技有限公司 2021-02-09 CN disclosed