SCHEMBL28877801

SCHEMBL28877801

N[C@@H](CO)C(=O)Oc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.44
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40
PPARA Q07869 4/20 0.39
PPARG P37231 3/20 0.39
ELANE P08246 1/20 0.39
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
PMP22 Q01453 2/20 0.38
LIPE Q05469 2/20 0.38
ABCB11 O95342 1/20 0.38

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
SCHEMBL28758996 0.84 TDP1 (0.40) CYP1A2ELANECYP3A4CYP2C9CYP2C19
SCHEMBL6018863 0.84 SLC7A5 (0.42) ELANE
SCHEMBL29169947 0.82 SCN9A (0.43) CYP1A2PPARAPPARGELANE
SCHEMBL27623103 0.82 LDHA (0.42) ELANELMNAPOLB
SCHEMBL2564139 0.81 ATM (0.46) CYP1A2ELANECYP2D6LTA4H
SCHEMBL16086931 0.81 ATM (0.46) CYP1A2ELANECYP2D6LTA4H
Water SCHEMBL10790799 0.80 ATM (0.45) CYP1A2ELANELTA4H
SCHEMBL3107851 0.80 CYP1A2 (0.45) CYP1A2PPARAPPARGELANECYP3A4
SCHEMBL4540212 0.79 MAPT (0.48) ELANETSHRLMNAPOLB
SCHEMBL28954314 0.79 MAPT (0.48) ELANETSHRLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115266977-B HPLC method for measuring DL-p-chlorostyrene ethyl ester content 山东普洛汉兴医药有限公司 2024-02-27 CN disclosed
CN-115266977-A HPLC method for determining DL-p-chlorophenyl serine ethyl ester content 山东普洛汉兴医药有限公司 2022-11-01 CN disclosed
CN-115266977-A HPLC method for determining DL-p-chlorophenyl serine ethyl ester content 山东普洛汉兴医药有限公司 2022-11-01 CN disclosed