SCHEMBL23004696

SCHEMBL23004696

COc1ccc(F)c(-c2cc(O)c([N+](=O)[O-])c([N+](=O)[O-])c2F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
GFER P55789 1/20 0.38
NPC1 O15118 2/20 0.38
HSP90AA1 P07900 1/20 0.38
PKM P14618 1/20 0.38
PAX8 Q06710 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
AMY1A P0DUB6 1/20 0.37
CLK1 P49759 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL8774775 0.76 IDH2 (0.44) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL8774927 0.74 ALDH1A1 (0.44) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL23004695 0.72 HSPB1 (0.41) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL7350863 0.71 HSP90AA1 (0.42) RAB9AMAPTALDH1A1KDM4EGAA
SCHEMBL6649633 0.70 CTSV (0.56) KMT2AMEN1MAPTALDH1A1KDM4E
SCHEMBL69213 0.69 CYP3A4 (0.50) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL16318931 0.69 NPC1 (0.45) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL3192746 0.69 ALDH1A1 (0.56) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL29744326 0.69 ALDH1A1 (0.56) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL2314995 0.68 VCAM1 (0.50) KMT2AMEN1RAB9AMAPTALDH1A1

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-11472794-B2 Fused imidazole derivatives as IL-17 modulators UCB Biopharma SRL (BE) 2022-10-18 US disclosed
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators UCB Biopharma SRL (BE) 2021-02-25 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 (2 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-11472794-B2 Fused imidazole derivatives as IL-17 modulators IL17A, IL2, IL23R KMT2A 1912/4885MEN1 2755/4885RAB9A 1521/4885
US-20210053952-A1 Fused Imidazole Derivatives as IL-17 Modulators IL17A, IL2, IL23R KMT2A 1912/4885MEN1 2755/4885RAB9A 1521/4885

“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.