SCHEMBL8945380

SCHEMBL8945380

CCO[Si](CCCc1ccc(N)cc1)(OCC)OCC.CO[Si](OC)(OC)c1cccc(N)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.39
MAOB P27338 5/20 0.35
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
PRSS1 P07477 1/20 0.31
MAOA P21397 3/20 0.31
GFER P55789 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
SCHEMBL8771710 0.89 CYP19A1 (0.32) CYP19A1
SCHEMBL9074670 0.85 CYP19A1 (0.38) CYP19A1MAOBTP53CYP3A4SIGMAR1
SCHEMBL7857768 0.82 MAOB (0.46) CYP19A1MAOBCYP3A4MAOAGFER
SCHEMBL16756615 0.79 MAOB (0.47) CYP19A1MAOBTP53CYP3A4SIGMAR1
SCHEMBL4440676 0.75 TP53 (0.32) TP53CYP3A4
SCHEMBL17442492 0.74 ALDH1A1 (0.36) TP53CYP3A4
SCHEMBL30021520 0.74 ALDH1A1 (0.48) CYP19A1MAOBTP53CYP3A4MAOA
SCHEMBL112433 0.74 ALDH1A1 (0.48) CYP19A1MAOBTP53CYP3A4MAOA
SCHEMBL8961106 0.73 HTR2A (0.39)
SCHEMBL8960954 0.73 GFER (0.48) CYP19A1MAOBCYP3A4MAOAGFER

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
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed