SCHEMBL28205644

SCHEMBL28205644

CCCCCNC(C(N)=O)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
EPHX1 P07099 9/20 0.42
DPP7 Q9UHL4 2/20 0.41
CNR1 P21554 2/20 0.40
PLA2G2A P14555 1/20 0.40
PLA2G5 P39877 1/20 0.40
CNR2 P34972 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
RRM1 P23921 1/20 0.38
CASP2 P42575 1/20 0.37
TP53 P04637 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
SCHEMBL27874766 0.98 SMN1; SMN2 (0.47) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
SCHEMBL18171393 0.98 SMN1; SMN2 (0.47) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
SCHEMBL18171395 0.98 SMN1; SMN2 (0.47) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
Hydrochloric Acid SCHEMBL7769081 0.96 SMN1; SMN2 (0.46) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
Hydrochloric Acid SCHEMBL7770689 0.96 SMN1; SMN2 (0.46) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
Hydrochloric Acid SCHEMBL7769028 0.96 SMN1; SMN2 (0.46) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A
SCHEMBL16852138 0.86 SMN1; SMN2 (0.37) SMN1; SMN2EPHX1CNR1PLA2G2APLA2G5
SCHEMBL9802172 0.85 EPHX1 (0.40) SMN1; SMN2EPHX1DPP7CA1CA2
SCHEMBL22829569 0.84 SMN1; SMN2 (0.54) SMN1; SMN2EPHX1DPP7PLA2G2APLA2G5
SCHEMBL21727098 0.83 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1DPP7CNR1PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107872955-A Beneficial to the bacillus licheniformis RTI184 compositions and its application method of plant growth FMC有限公司 2018-04-03 CN disclosed
CN-107846876-A Bacillus amyloliquefaciens RTI301 compositions and for beneficial to plant growth and treatment plant disease method FMC有限公司 2018-03-27 CN disclosed