SCHEMBL33527983

SCHEMBL33527983

O=[N+]([O-])c1ccc(F)c(Br)c1I

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
ATM Q13315 1/20 0.50
ALDH1A1 P00352 3/20 0.44
HIF1A Q16665 2/20 0.44
VCAM1 P19320 1/20 0.42
MAPT P10636 4/20 0.41
CASP6 P55212 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 3/20 0.37
MAPK1 P28482 2/20 0.37
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
CYP3A4 P08684 2/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
CYP1A2 P05177 1/20 0.35
HSPB1 P04792 3/20 0.35

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
SCHEMBL6978734 0.82 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL660797 0.80 TDP1 (0.48) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29711979 0.80 TDP1 (0.48) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL8817806 0.78 TDP1 (0.47) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29507015 0.77 CYP1A2 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL10835047 0.77 GPR35 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL34460054 0.77 ALDH1A1 (0.47) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL22833410 0.77 CYP1A2 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29069638 0.77 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL3345953 0.77 ALDH1A1 (0.47) TDP1ATMALDH1A1HIF1AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260096344-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO LTD (KR) 2026-04-02 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-20260096344-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND CRY1, LBR, CXCR1 TDP1 3148/4885ATM 4429/4885ALDH1A1 844/4885

“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.