SCHEMBL13701007

SCHEMBL13701007

Cc1nsc2cccc(C(F)(F)F)c12

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HSD11B1 P28845 3/20 0.35
AXL P30530 1/20 0.35
PSMB8 P28062 1/20 0.34
MPL P40238 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
XPO1 O14980 1/20 0.33
KCNA5 P22460 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EPHX2 P34913 1/20 0.33
USP36 Q9P275 1/20 0.32
PARP1 P09874 1/20 0.32
MRGPRX1 Q96LB2 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
SCHEMBL8404470 0.75 ALDH1A1 (0.37) ALDH1A1NPC1RAB9AKCNA5MAPT
SCHEMBL31165845 0.72 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL3402475 0.69 KCNA5 (0.48) ALDH1A1L3MBTL1MEN1KMT2ANPC1
SCHEMBL25833188 0.69 GABRA1 (0.38)
SCHEMBL17139919 0.69 MEN1 (0.36) ALDH1A1L3MBTL1HSD11B1MPLMEN1
SCHEMBL5543350 0.68 HSD11B1 (0.32) ALDH1A1L3MBTL1HSD11B1MPLXPO1
SCHEMBL25667844 0.67
SCHEMBL10628456 0.67 HSD11B1 (0.37) ALDH1A1L3MBTL1HSD11B1AXLPSMB8
SCHEMBL22349121 0.66
SCHEMBL22891113 0.66 ALDH1A1 (0.43) ALDH1A1L3MBTL1HSD11B1MPLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 US disclosed
US-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound FUJIFILM CORPORATION (JP) 2009-09-24 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 (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-20090239982-A1 Ultraviolet Absorbent and Heterocyclic Compound CYP2A6, CYP2B6, XPO6 ALDH1A1 1360/4885L3MBTL1 2124/4885HSD11B1 1664/4885

“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.