SCHEMBL25827289

SCHEMBL25827289

CCOC(=O)CCNC(=O)C(N)[C@@H](C)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TERT O14746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
IARS1 P41252 2/20 0.34
REN P00797 1/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
CTSL P07711 1/20 0.34

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
SCHEMBL25826934 1.00 CYP1A2 (0.40) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL25827282 1.00 CYP1A2 (0.40) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL7396618 0.87 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL7358388 0.86 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6CYP2C19GAA
Hydrochloric Acid SCHEMBL7396617 0.86 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL7140073 0.83 CYP1A2 (0.44) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL10448209 0.80 ECE1 (0.50) TERTUSP2TSHRDPP4DPP8
SCHEMBL10448521 0.80 MEN1 (0.49) L3MBTL1KMT2ACTSLCTSB
SCHEMBL10085314 0.80 GAA (0.46) CYP1A2CYP3A4CYP2D6CYP2C19GAA
SCHEMBL5494763 0.78 ANPEP (0.41) CYP1A2CYP3A4CYP2D6CYP2C19GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023125792-A1 MULTI-SUBSTITUTED URACIL DERIVATIVE AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 杭州奥默医药股份有限公司 2023-07-06 WO disclosed