SCHEMBL2809535

SCHEMBL2809535

CC(=CSc1ccc(F)cc1)C(=Nc1ccccc1)Sc1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.36
HIF1A Q16665 1/20 0.36
MAPT P10636 6/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NOS3 P29474 4/20 0.34
NOS1 P29475 4/20 0.34
ACHE P22303 1/20 0.33
NFE2L2 Q16236 1/20 0.32
ATM Q13315 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL2809533 1.00 CYP2D6 (0.36) CYP2D6HIF1AMAPTMEN1KMT2A
SCHEMBL12850856 1.00 CYP2D6 (0.36) CYP2D6HIF1AMAPTMEN1KMT2A
SCHEMBL2812874 0.96 NOS3 (0.36) CYP2D6HIF1AMAPTMEN1KMT2A
SCHEMBL2812876 0.96 NOS3 (0.36) CYP2D6HIF1AMAPTMEN1KMT2A
SCHEMBL12850926 0.95 NOS3 (0.38) NOS3NOS1
SCHEMBL2809067 0.95 NOS3 (0.38) NOS3NOS1
SCHEMBL2809065 0.95 NOS3 (0.38) NOS3NOS1
SCHEMBL2808668 0.93 NOS3 (0.37) NOS3NOS1
SCHEMBL2808669 0.93 NOS3 (0.37) NOS3NOS1
SCHEMBL12850836 0.93 NOS3 (0.37) NOS3NOS1

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-8278473-B2 Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-02 US disclosed
US-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
WO-2009064031-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-22 WO 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-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME OXER1, CBR1, DEGS1 CYP2D6 1112/4885HIF1A 2986/4885MAPT 4608/4885

“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.