SCHEMBL26464539

SCHEMBL26464539

CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ CHRM2 P08172 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ CHRM3 P20309 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ ATM Q13315 3/20 0.34
▸ HTRA1 Q92743 1/20 0.34
▸ NR1H2 P55055 1/20 0.33
▸ AR P10275 1/20 0.32
▸ P2RX3 P56373 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ ANPEP P15144 1/20 0.31
▸ DDB1 Q16531 1/20 0.31
▸ CRBN Q96SW2 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ DPP4 P27487 2/20 0.31

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
SCHEMBL26464083 1.00 CYP1A2 (0.47) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL26464816 1.00 CYP1A2 (0.47) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL26464450 1.00 CYP1A2 (0.47) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL26464715 1.00 CYP1A2 (0.47) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL5963539 0.86 HSD11B1 (0.36) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL17970102 0.82 CYP1A2 (0.34) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL12218320 0.82 CYP1A2 (0.52) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL12327236 0.82 CYP1A2 (0.52) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL3188827 0.82 CYP1A2 (0.52) CYP1A2POLBCYP3A4CYP2C19CHRM2
SCHEMBL31107728 0.82 CYP1A2 (0.52) CYP1A2POLBCYP3A4CYP2C19CHRM2

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
WO-2023071895-A1 HYDROXYPROLYL-SERINE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 苏州裕泰医药科技有限公司 2023-05-04 — — WO disclosed
WO-2023071896-A1 HYDROXYPROLYL-SERINE COMPOUND, AND PREPARATION AND APPLICATION THEREOF 苏州裕泰医药科技有限公司 2023-05-04 — — WO disclosed
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