SCHEMBL10359474

SCHEMBL10359474

[CH2]C(=O)NCCc1ccc(OC)c(OC)c1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.73
CA1 P00915 1/20 0.73
CA2 P00918 1/20 0.73
CA9 Q16790 1/20 0.73
MAPT P10636 1/20 0.69
KMT2A Q03164 3/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
ALDH1A1 P00352 4/20 0.66
MEN1 O00255 2/20 0.64
GAA P10253 1/20 0.64
NAMPT P43490 1/20 0.64
POLB P06746 1/20 0.63
ATM Q13315 1/20 0.63
THRB P10828 1/20 0.61

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
SCHEMBL8099685 0.87 CA1 (0.73) CA12CA1CA2CA9MAPT
SCHEMBL7265002 0.87 CA12 (0.73) CA12CA1CA2CA9MAPT
SCHEMBL901614 0.87 CA12 (0.73) CA12CA1CA2CA9MAPT
SCHEMBL2224069 0.87 CA12 (0.73) CA12CA1CA2CA9MAPT
SCHEMBL27498619 0.86 CA12 (0.68) CA12CA1CA2CA9MAPT
Water SCHEMBL11279885 0.86 CA12 (0.71) CA12CA1CA2CA9MAPT
SCHEMBL20553937 0.85 ALDH1A1 (0.76) KMT2ASMN1; SMN2ALDH1A1MEN1GAA
SCHEMBL11845550 0.85 SMN1; SMN2 (0.73) CA12CA1CA2CA9MAPT
SCHEMBL4022887 0.84 KMT2A (0.87) CA12CA1CA2CA9MAPT
SCHEMBL13853577 0.84 CA12 (0.69) CA12CA1CA2CA9MAPT

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
EP-0192255-B1 BIS-2H-PYRROLIDINE DIONES CIBA-GEIGY AG (CH) 1990-08-08 EP disclosed
US-4789674-A ALZHEIMER'S DISEASE, MEMORY, DEMENTIA CIBA-GEIGY CORPORATION (US) 1988-12-06 US disclosed
US-4758575-A Bi-2H-pyrroli(di)nediones CIBA-GEIGY CORPORATION (US) 1988-07-19 US disclosed
EP-0192255-A2 Bis-2H-pyrrolidine diones CIBA-GEIGY AG (CH) 1986-08-27 EP disclosed
US-4289883-A ADRENERGIC BLOCKING AGENTS OF EXCELLENT CARDIOSELECTIVITY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1981-09-15 US disclosed