SCHEMBL2963682

SCHEMBL2963682

CC1=C(c2c(C)cc(C)cc2C)c2cc(Br)ccc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.36
ROS1 P08922 1/20 0.36
MARK3 P27448 1/20 0.36
LTK P29376 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
MINK1 Q8N4C8 1/20 0.36
AURKB Q96GD4 1/20 0.36
PBK Q96KB5 1/20 0.36
STK17A Q9UEE5 1/20 0.36
MAP4K5 Q9Y4K4 1/20 0.36
RAPGEF4 Q8WZA2 2/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
TYMS P04818 1/20 0.33
METAP1 P53582 1/20 0.33
PGR P06401 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TDP2 O95551 1/20 0.32

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
SCHEMBL2965972 0.90 METAP1 (0.39) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2974708 0.79 ESR1 (0.44) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2970474 0.75 TDP1 (0.39) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2972164 0.75 TDP1 (0.36) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2974433 0.73 CHEK2 (0.43) CHEK2ROS1MARK3LTKFLT4
SCHEMBL16913152 0.73 ESR1 (0.43) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2975148 0.71 MEN1 (0.47) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2967198 0.71 RAPGEF4 (0.32) RAPGEF4MEN1ALDH1A1MAPTKMT2A
SCHEMBL26758404 0.70 CHEK2 (0.41) CHEK2ROS1MARK3LTKFLT4
SCHEMBL2966003 0.70 PIM1 (0.33) RAPGEF4PARP10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 CHEK2 3533/4885ROS1 820/4885MARK3 595/4885

“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.