SCHEMBL4201024

SCHEMBL4201024

CCC1Cc2cc(C)cc(-c3ccc(C(C)(C)C)cc3)c2C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.35
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 3/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
ACHE P22303 1/20 0.32
TSHR P16473 2/20 0.31
GLA P06280 2/20 0.31
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NR1I2 O75469 1/20 0.31
GMNN O75496 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 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
SCHEMBL4198355 0.83 ACHE (0.47) BRD4CREBBPMEN1KMT2AMAPT
SCHEMBL5953291 0.82 CREBBP (0.42) METAP1BRD4CREBBPACHE
SCHEMBL1023551 0.76 MAOA (0.36) BRD4CREBBPMEN1KMT2ANPC1
SCHEMBL8165742 0.75 BRD4 (0.36) METAP1BRD4CREBBPACHEGAA
SCHEMBL5951772 0.72 CREBBP (0.40) METAP1BRD4CREBBPACHE
SCHEMBL5951443 0.72 METAP1 (0.39) METAP1MEN1KMT2AACHE
SCHEMBL2424388 0.72 BRD4 (0.39) BRD4CREBBPNPC1RAB9AACHE
SCHEMBL4191634 0.71 METAP1 (0.36) METAP1MEN1KMT2AMAPTNPC1
SCHEMBL2387022 0.71 CREBBP (0.41) METAP1BRD4CREBBPACHE
SCHEMBL5952782 0.71 ACHE (0.41) METAP1BRD4CREBBPACHE

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
EP-1636245-B1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2009-02-25 EP disclosed
US-20060252637-A1 Bisindenyl zirconium complexes for use in the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2006-11-09 US disclosed
EP-1636245-A1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS Basell Polyolefine GmbH (DE) 2006-03-22 EP disclosed
WO-2004106351-A1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-12-09 WO disclosed