SCHEMBL7572188

SCHEMBL7572188

Cc1ccc(-c2ccccn2)c2c1C([Zr](Cl)Cl)C([Si](C)(C)C)=C2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
NPC1 O15118 5/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PKM P14618 2/20 0.33
MITF O75030 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 2/20 0.32
TP53 P04637 3/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31

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
SCHEMBL7569895 0.82 NPC1 (0.32) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7572181 0.81 MAOA (0.35) MAOANPC1RAB9ASMN1; SMN2PKM
SCHEMBL7566250 0.81 ADRA1A (0.37) NPC1RAB9ASMN1; SMN2PKMMITF
SCHEMBL7565115 0.77 MAOA (0.33) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7565120 0.76 MAOA (0.34) MAOANPC1RAB9ASMN1; SMN2PKM
SCHEMBL7568944 0.71 KDM4E (0.34) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7568942 0.70 KDM4E (0.36) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7569889 0.68 NPC1 (0.33) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7570610 0.68 MAOA (0.34) MAOANPC1RAB9ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7564447 0.68 NPC1 (0.33) MAOANPC1RAB9ASMN1; SMN2PKM

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