SCHEMBL15522202

SCHEMBL15522202

CC(C)(C)[Si](C)(C)OCCNc1cnc2c(ccn2-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 7/20 0.43
KCNH2 Q12809 1/20 0.33
CHRNA7 P36544 2/20 0.33
DGAT1 O75907 1/20 0.32
LCK P06239 2/20 0.31
KDR P35968 2/20 0.31
KIT P10721 1/20 0.31
SRC P12931 1/20 0.31
DUT P33316 2/20 0.31
DHFR P00374 1/20 0.31
MCHR1 Q99705 1/20 0.31
JAK2 O60674 4/20 0.31
RPS6KA3 P51812 2/20 0.31
AURKA O14965 1/20 0.31
DAPK3 O43293 1/20 0.31
PAK4 O96013 1/20 0.31
ABL1 P00519 1/20 0.31
NTRK1 P04629 1/20 0.31
FYN P06241 1/20 0.31
CSF1R P07333 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
SCHEMBL16167709 0.82 PTK2 (0.46) PTK2KCNH2CHRNA7LCKKDR
SCHEMBL15522081 0.77 DUT (0.34) DUT
SCHEMBL15522187 0.77 PTGES (0.38) DGAT1KDRSRCAURKAPDGFRB
SCHEMBL15522136 0.75 DGAT1 (0.41) PTK2KCNH2CHRNA7DGAT1KDR
SCHEMBL15521971 0.72 DGAT1 (0.39) KCNH2DGAT1KITDUTFLT3
SCHEMBL15733091 0.72 DGAT1 (0.53) KCNH2DGAT1KDRKITDUT
SCHEMBL15522193 0.71 DGAT1 (0.66) PTK2CHRNA7DGAT1
SCHEMBL31591370 0.71 PTK2 (0.44) PTK2KCNH2LCKKDRKIT
SCHEMBL14136858 0.71 PTK2 (0.44) PTK2KCNH2LCKKDRKIT
SCHEMBL1969773 0.71 IDO1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9540400-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-01-10 US disclosed
US-20160200736-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-07-14 US disclosed
EP-2710013-B1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-06-29 EP disclosed
US-9273069-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-03-01 US disclosed
US-20150225425-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-08-13 US disclosed
US-9040517-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2015-05-26 US disclosed
US-20140378434-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-12-25 US disclosed
US-8859536-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-14 US disclosed
US-20140080809-A1 Novel Compounds as Diacylglycerol Acyltransferase Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-03-20 US 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 (4 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-20160200736-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, LCAT PTK2 3259/4885KCNH2 4392/4885CHRNA7 4807/4885
US-20150225425-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, LCAT PTK2 3259/4885KCNH2 4392/4885CHRNA7 4807/4885
US-20140378434-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, LCAT PTK2 3259/4885KCNH2 4392/4885CHRNA7 4807/4885
US-20140080809-A1 Novel Compounds as Diacylglycerol Acyltransferase Inhibitors DGAT1, DGAT2, LCAT PTK2 3259/4885KCNH2 4392/4885CHRNA7 4807/4885

“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.