SCHEMBL9717664

SCHEMBL9717664

CCC[CH]C(=O)NCCc1ccc(OC)c(OC)c1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.68
ALDH1A1 P00352 3/20 0.67
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
MAPT P10636 5/20 0.61
KDM4E B2RXH2 1/20 0.60
PKM P14618 1/20 0.60
LMNA P02545 3/20 0.58
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
HPGD P15428 1/20 0.57
HTT P42858 1/20 0.57
NAMPT P43490 1/20 0.56

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
SCHEMBL17507201 0.83 SMN1; SMN2 (0.80) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL11845550 0.82 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL19718558 0.82 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL6093690 0.82 MAPT (0.69) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL21093408 0.81 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL5192269 0.80 KMT2A (0.74) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL1820807 0.79 CA12 (0.69) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL10359474 0.79 CA12 (0.73) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL8099685 0.79 CA1 (0.73) SMN1; SMN2ALDH1A1CA12CA1CA2
SCHEMBL901614 0.79 CA12 (0.73) SMN1; SMN2ALDH1A1CA12CA1CA2

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
EP-0493683-A1 Fungicidal amino acid amides AMERICAN CYANAMID COMPANY (US) 1992-07-08 EP disclosed