SCHEMBL4078183

SCHEMBL4078183

Nc1cccc2ccc(C(F)(F)F)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.49
PLG P00747 1/20 0.49
PLAU P00749 1/20 0.49
PLAT P00750 1/20 0.49
KLK1 P06870 1/20 0.49
PRSS1 P07477 1/20 0.49
TSHR P16473 3/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 8/20 0.48
HPGD P15428 4/20 0.48
HSD17B10 Q99714 3/20 0.48
CYP3A4 P08684 2/20 0.48
KEAP1 Q14145 1/20 0.48
MAPT P10636 4/20 0.46
KDM4E B2RXH2 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
POLB P06746 2/20 0.46

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
SCHEMBL4074888 0.85 TSHR (0.48) TSHRMAPK1ALDH1A1HPGDHSD17B10
SCHEMBL23478929 0.81 F2 (0.49) F2PLGPLAUPLATKLK1
SCHEMBL10408737 0.78 ALDH1A1 (0.56) TSHRALDH1A1HPGDHSD17B10MAPT
SCHEMBL23206122 0.77 CYP1A2 (0.57) TSHRMAPK1ALDH1A1HPGDHSD17B10
SCHEMBL18243149 0.77 PTPRC (0.44) TSHRMAPK1KDM4EBACE1KIF11
SCHEMBL4727635 0.77 CTDSP1 (0.53) PLAUHPGDMAPTKDM4EL3MBTL1
SCHEMBL8276130 0.77 TAAR1 (0.42) TSHRMAPK1BACE1KIF11PTPRC
SCHEMBL3827071 0.76 BACE1 (0.43) TSHRMAPK1ALDH1A1HPGDHSD17B10
SCHEMBL12472954 0.74 KIF11 (0.44) HSD17B10MAPTKDM4EBACE1KIF11
SCHEMBL12310592 0.74 KIF11 (0.44) HSD17B10MAPTKDM4EBACE1KIF11

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-7482339-B2 2-Naphthylimino-1,3-thiazine derivative SHIONOGI AND CO., LTD. (JP) 2009-01-27 US disclosed
US-20060281738-A1 2-Naphthylimino-1,3-thiazine derivative SHIONOGI AND CO., LTD. (JP) 2006-12-14 US disclosed
EP-1659117-A1 2-NAPHTHYLIMINO-1,3-THIAZINE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2006-05-24 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 (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-20060281738-A1 2-Naphthylimino-1,3-thiazine derivative NPM1, OXTR, CYP2S1 F2 188/4885PLG 1570/4885PLAU 4363/4885

“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.