SCHEMBL7565115

SCHEMBL7565115

Cc1ccc(-c2ccccn2)c2c1C([Zr](Cl)(Cl)(C1C([Si](C)(C)C)=Cc3c(-c4ccccn4)ccc(C)c31)[SiH](C)C)C([Si](C)(C)C)=C2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
NPC1 O15118 1/20 0.30
MITF O75030 1/20 0.30
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
DCTPP1 Q9H773 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
SCHEMBL5952691 0.87 MAOA (0.33) MAOANPC1
SCHEMBL7564070 0.84 GABRG2 (0.32) MAOA
SCHEMBL7571196 0.83 MAOA (0.31) MAOA
SCHEMBL7564433 0.83 ADRA1A (0.32) SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL7565120 0.82 MAOA (0.34) MAOANPC1MITFGAAPKM
SCHEMBL7565961 0.81 CYP1A2 (0.32)
SCHEMBL8361413 0.80
SCHEMBL7566516 0.78
Hydrochloric Acid SCHEMBL7572181 0.77 MAOA (0.35) MAOANPC1MITFGAAPKM
SCHEMBL7565550 0.77 MAOA (0.31) MAOA

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-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US claimed
EP-0743317-B1 Metallocenes comprising a heterocycle and catalysts containing them BASELL POLYOLEFINE GMBH (DE) 2002-08-28 EP disclosed
US-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US disclosed
EP-0743317-A2 Metallocenes comprising a heterocycle and catalysts containing them HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-20 EP disclosed