SCHEMBL4087525

SCHEMBL4087525

Nc1cccc2c(OCc3ccccc3)cccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 1/20 0.55
PLAU P00749 1/20 0.54
PLAT P00750 1/20 0.54
LTA4H P09960 2/20 0.53
APP P05067 1/20 0.53
MAPK14 Q16539 1/20 0.53
F2 P00734 2/20 0.51
PLA2G2A P14555 1/20 0.48
TRPM8 Q7Z2W7 1/20 0.48
DCPS Q96C86 1/20 0.48
HTR1A P08908 1/20 0.47
DRD2 P14416 1/20 0.47
F9 P00740 1/20 0.47
F10 P00742 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 1/20 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
SCHEMBL4074725 0.91 IDO1 (0.53) MAPTTDP1L3MBTL1MAPK1PLAU
SCHEMBL292275 0.83 APP (0.72) MAPTTDP1L3MBTL1MAPK1LTA4H
SCHEMBL416462 0.82 MAPT (0.57) MAPTTDP1L3MBTL1MAPK1PLAU
SCHEMBL29380769 0.82 MAPT (0.57) MAPTTDP1L3MBTL1MAPK1PLAU
SCHEMBL3489533 0.81 MAPT (0.58) MAPTTDP1L3MBTL1MAPK1LTA4H
Hydrochloric Acid SCHEMBL584918 0.81 APP (0.70) MAPTTDP1L3MBTL1MAPK1LTA4H
SCHEMBL27629 0.79 MRGPRX4 (0.67) MAPTTDP1L3MBTL1MAPK1F2
SCHEMBL29568609 0.79 MRGPRX4 (0.67) MAPTTDP1L3MBTL1MAPK1F2
SCHEMBL6537540 0.79 PLAU (0.51) MAPTTDP1L3MBTL1MAPK1PLAU
SCHEMBL23159060 0.79 ALDH1A1 (0.56) TDP1ALDH1A1CYP3A4HPGDTSHR

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 MAPT 3096/4885TDP1 3815/4885L3MBTL1 1335/4885

“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.