SCHEMBL2235659

SCHEMBL2235659

Cc1ccc2c(c1-c1ccccc1)C=C(Br)C2

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 2/20 0.31
AKT1 P31749 1/20 0.31
AKT3 Q9Y243 1/20 0.31
BRD4 O60885 1/20 0.31
TDO2 P48775 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL2236464 0.97 ALDH1A1 (0.34) AKT2AKT1AKT3MAPK1TDP1
SCHEMBL2234205 0.88 ALDH1A1 (0.34) MAPK1L3MBTL1
SCHEMBL4626589 0.84 AKT2 (0.33) AKT2AKT1AKT3BRD4TDO2
SCHEMBL6908173 0.84 AKT2 (0.33) AKT2AKT1AKT3BRD4TDO2
SCHEMBL2237566 0.82 IKBKB (0.40) KMT2AHPGDMAPTKDM4ETDP1
SCHEMBL2235551 0.82 NPC1 (0.33) KMT2AMAPT
SCHEMBL2234221 0.82 MEN1 (0.31) KMT2AMAPT
SCHEMBL2235097 0.81 MAPT (0.37) KMT2AHPGDMAPTKDM4EMAPK1
SCHEMBL2234405 0.81 TSHR (0.32) HPGDMAPT
SCHEMBL15712969 0.81 MAPT (0.33) AKT2AKT1AKT3KMT2AMAPT

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2360163-B1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN JAPAN POLYPROPYLENE CORP (JP) 2014-06-25 EP disclosed
US-8461365-B2 Metallocene complex and polymerization method of olefin JAPAN POLYPROPYLENE CORPORATION (JP) 2013-06-11 US disclosed
US-8461365-B2 Metallocene complex and polymerization method of olefin JAPAN POLYPROPYLENE CORPORATION (JP) 2013-06-11 US disclosed
US-8461365-B2 Metallocene complex and polymerization method of olefin JAPAN POLYPROPYLENE CORPORATION (JP) 2013-06-11 US disclosed
CN-102245620-A Metallocene complex and method for polymerizing olefin JAPAN POLYPROPYLENE CORP 2011-11-16 CN disclosed
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN JAPAN POLYPROPYLENE CORPORATION (JP) 2011-09-22 US disclosed
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN JAPAN POLYPROPYLENE CORPORATION (JP) 2011-09-22 US disclosed
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN JAPAN POLYPROPYLENE CORPORATION (JP) 2011-09-22 US disclosed
EP-2360163-A1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN Japan Polypropylene Corporation (JP) 2011-08-24 EP disclosed
EP-2360163-A1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN Japan Polypropylene Corporation (JP) 2011-08-24 EP disclosed
WO-2010071099-A1 METALLOCENE COMPLEX AND METHOD FOR POLYMERIZING OLEFIN 日本ポリプロ株式会社 (JP) 2010-06-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110230622-A1 METALLOCENE COMPLEX AND POLYMERIZATION METHOD OF OLEFIN ALOX12, ALOX15, ALOX15B AKT2 3526/4885AKT1 2671/4885AKT3 3421/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.