SCHEMBL28526224

SCHEMBL28526224

CCCCCCCCCCCCCCCC(=O)N[C@@H](COCc1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.60
FOLH1 Q04609 1/20 0.57
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PPARA Q07869 1/20 0.53
NOD1 Q9Y239 1/20 0.52
EPHX2 P34913 1/20 0.52
MME P08473 1/20 0.51
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
LPAR1 Q92633 2/20 0.51
LPAR3 Q9UBY5 1/20 0.51

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
SCHEMBL28526228 1.00 FAAH (0.60) FAAHFOLH1MEN1KMT2APPARA
SCHEMBL28514512 0.94 FAAH (0.54) FAAHFOLH1MEN1KMT2APPARA
SCHEMBL28517231 0.88 FAAH (0.50) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL28517232 0.88 FAAH (0.50) FAAHMEN1KMT2ANOD1EPHX2
SCHEMBL18630185 0.86 FAAH (0.48) FAAHMEN1KMT2AITGB3ITGA2B
SCHEMBL28514511 0.84 FAAH (0.47) FAAHFOLH1MEN1KMT2AEPHX2
SCHEMBL27932795 0.84 FOLH1 (0.61) FOLH1KMT2APPARAMME
SCHEMBL27932798 0.84 FOLH1 (0.61) FOLH1KMT2APPARAMME
SCHEMBL13030121 0.84 CERT1 (0.60) MEN1KMT2AEPHX2LPAR1LPAR3
SCHEMBL4057815 0.83 FAAH (0.57) FAAHMEN1KMT2ANOD1EPHX2

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