SCHEMBL9429318

SCHEMBL9429318

CCCCC[CH]C(=O)NC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
RAB9A P51151 1/20 0.50
FAAH O00519 4/20 0.46
SOAT1 P35610 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
CNR1 P21554 1/20 0.43
KDM4E B2RXH2 2/20 0.42
EP300 Q09472 1/20 0.38
TERT O14746 3/20 0.37
BLM P54132 2/20 0.37
HSD17B10 Q99714 2/20 0.37
FABP4 P15090 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL9428496 0.94 MAPT (0.51) MAPTNPSR1RAB9AFAAHSOAT1
SCHEMBL9428766 0.85 MAPT (0.46) MAPTNPSR1RAB9AFAAHSOAT1
Hexane SCHEMBL27799263 0.78 MAPT (0.48) MAPTNPSR1RAB9AFAAHSOAT1
SCHEMBL7906152 0.78 FAAH (0.47) MAPTNPSR1FAAHSOAT1CYP1A2
SCHEMBL1416049 0.77 EP300 (0.42) MAPTNPSR1FAAHSOAT1CYP1A2
SCHEMBL9428312 0.76
SCHEMBL1416084 0.76
Tridecane SCHEMBL28108265 0.75 EPHX1 (0.48) MAPTNPSR1RAB9AFAAHSOAT1
Heptane SCHEMBL27707941 0.75 EPHX1 (0.48) MAPTNPSR1RAB9AFAAHSOAT1
Decane SCHEMBL27678804 0.75 EPHX1 (0.48) MAPTNPSR1RAB9AFAAHSOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5306816-A Processes for preparing carbapenem derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-26 US disclosed
EP-0280771-B1 3-Pyrrolidinylthio-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid derivatives and processes for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-28 EP disclosed
EP-0499196-A1 Intermediates and process for preparing carbapenem derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-08-19 EP disclosed
US-5061804-A 3-thiopyrrolidine as chemical intermediates FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 US disclosed
US-4963543-A BACTERICIDES, TREATING INFECTIOUS DISEASES; THIENAMYCINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-10-16 US disclosed