SCHEMBL8680909

SCHEMBL8680909

CCOC(=O)C=C(C)NC(C(=O)O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
MDM4 O15151 1/20 0.50
MDM2 Q00987 1/20 0.50
ATM Q13315 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MMP8 P22894 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LTA4H P09960 1/20 0.40
ANPEP P15144 1/20 0.40
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FPR2 P25090 1/20 0.39

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
SCHEMBL28088781 1.00 MAPT (0.50) MAPTLMNAMDM4MDM2ATM
SCHEMBL9301284 1.00 MAPT (0.50) MAPTLMNAMDM4MDM2ATM
SCHEMBL8624954 0.99 MAPT (0.49) MAPTLMNAMDM4MDM2ATM
Diethyl Pyrocarbonate SCHEMBL11863610 0.94 MAPT (0.45) MAPTLMNAMDM4MDM2ATM
Diethyl Pyrocarbonate SCHEMBL11863590 0.94 MAPT (0.45) MAPTLMNAMDM4MDM2ATM
SCHEMBL11863602 0.91 MAPT (0.43) MAPTLMNAMDM4MDM2ATM
Potassium Ion SCHEMBL8624951 0.89 MAPT (0.48) MAPTLMNAMDM4MDM2ATM
SCHEMBL3987754 0.89 FOLH1 (0.46) MAPTLMNAMDM4MDM2ATM
SCHEMBL11607920 0.89 MAPT (0.48) MAPTLMNAMDM4MDM2ATM
SCHEMBL9301307 0.89 MAPT (0.48) MAPTLMNAMDM4MDM2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840885-A REACTING WITH A MIXED CARBOXYLIC ANHYDRIDE IN A HALOGEN-FREE SOLVENT BIOCHEMIE GESELLSCHAFT M.B.H. (AT) 1998-11-24 US claimed
US-5719276-A 1998-02-17 US claimed
US-5608055-A Beta lactam production BIOCHEMIE GESELLSCHAFT M.B.H. (AT) 1997-03-04 US claimed
CN-115989341-A Method for manufacturing structure with conductive pattern 旭化成株式会社 2023-04-18 CN disclosed
CN-105859746-A Synthesis method for aspoxicillin 江西富祥药业股份有限公司 2016-08-17 CN disclosed
CN-105769873-A Cefaclor preparation and preparation method thereof 华北制药河北华民药业有限责任公司 2016-07-20 CN disclosed
US-4053470-A BACTERICIDES, ANTIBIOTICS PARKE, DAVIS & COMPANY (US) 1977-10-11 US disclosed
US-3954734-A PENICILLIN AND CEPHALOSPORIN TYPE PARKE, DAVIS & COMPANY 1976-05-04 US disclosed