SCHEMBL11248631

SCHEMBL11248631

CCN(CC)P(=O)(O)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
S1PR2 O95136 1/20 0.30
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
S1PR5 Q9H228 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL11731209 0.85 FDPS (0.43) FDPSMMP1MMP2MMP3MMP8
SCHEMBL113460 0.75
SCHEMBL10519965 0.74
SCHEMBL2962794 0.74
SCHEMBL181792 0.73
SCHEMBL2961086 0.73
Hydrochloric Acid SCHEMBL2580425 0.72 CA2 (0.40) USP2ALOX15MEN1KMT2ACA2
N,N-Dimethylethanaminium SCHEMBL9049890 0.69 FDPS (0.46) FDPSMMP1MMP2MMP3MMP8
N,N-Dimethylethanaminium SCHEMBL9049895 0.69 FDPS (0.46) FDPSMMP1MMP2MMP3MMP8
N,N-Dimethylethanaminium SCHEMBL7539367 0.69 FDPS (0.46) FDPSMMP1MMP2MMP3MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4322374-A 2,4,4,4-Tetrahalobutanoic acid halide CIBA-GEIGY CORPORATION (US) 1982-03-30 US disclosed
US-4284821-A Dichlorovinylcyclobutanones, processes for preparing them, and their use as intermediates for producing pesticidal compositions CIBA-GEIGY CORPORATION (US) 1981-08-18 US disclosed
US-4242278-A Process for the preparation of 2-(2',2',2'-trihalogenoethyl)-4-halogenocyclobutan-1-ones CIBA-GEIGY CORPORATION (US) 1980-12-30 US disclosed
US-4061644-A FROM A FURAN AND AMMONIA CIBA-GEIGY CORPORATION (US) 1977-12-06 US disclosed