SCHEMBL1040238

SCHEMBL1040238

CN(C)c1ccc(C(F)(F)F)c(P(Cl)Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.43
CRHR1 P34998 5/20 0.38
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
JAK3 P52333 1/20 0.36
ALDH1A1 P00352 3/20 0.36
ALOX15 P16050 3/20 0.36
TSHR P16473 3/20 0.36
HSD17B10 Q99714 2/20 0.36
TERT O14746 1/20 0.34
APP P05067 1/20 0.34
PDK2 Q15119 1/20 0.34
GAA P10253 1/20 0.33
SOS1 Q07889 1/20 0.32
SLC2A1 P11166 1/20 0.31
ACP1 P24666 1/20 0.31
KCNH2 Q12809 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD11B1 P28845 1/20 0.31
CYP3A4 P08684 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
SCHEMBL1043335 0.87 AR (0.42) ARCRHR1JAK2JAK1JAK3
SCHEMBL1039757 0.84 AR (0.42) ARCRHR1JAK2JAK1JAK3
SCHEMBL1039397 0.77 AR (0.45) ARCRHR1JAK2JAK1JAK3
SCHEMBL1042542 0.77 ALDH1A1 (0.39) ALDH1A1ALOX15TSHRHSD17B10TERT
SCHEMBL24687543 0.75 AR (0.46) ARCRHR1JAK2JAK1JAK3
SCHEMBL22897745 0.73 AR (0.45) ARCRHR1JAK2JAK1JAK3
SCHEMBL1041098 0.73 ALDH1A1 (0.39) ALDH1A1ALOX15TSHRHSD17B10TERT
SCHEMBL15934283 0.73 AR (0.45) ARCRHR1JAK2JAK1JAK3
SCHEMBL1040705 0.73 AR (0.45) ARCRHR1JAK2JAK1JAK3
SCHEMBL26020164 0.73 AR (0.45) ARCRHR1JAK2JAK1JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
EP-2272852-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex Sumitomo Chemical Company, Limited (JP) 2011-01-12 EP disclosed
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED 2009-06-04 US disclosed
US-7482414-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-27 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 US disclosed
EP-1683802-A1 TRANSITION METAL COMPLEX LIGAND AND OLEFIN POLYMERIZATION CATALYST CONTAINING TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2006-07-26 EP 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 (2 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-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 AR 1364/4885CRHR1 1447/4885JAK2 1856/4885
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 AR 1364/4885CRHR1 1447/4885JAK2 1856/4885

“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.