SCHEMBL21296776

SCHEMBL21296776

CC(=O)Oc1ccc(C(=O)Nc2cccc(-c3ccnn3C(=O)OC(C)(C)C)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.53
LMNA P02545 3/20 0.53
HTT P42858 3/20 0.52
POLB P06746 2/20 0.52
PKM P14618 2/20 0.52
RECQL P46063 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 4/20 0.51
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 5/20 0.49
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
ADORA3 P0DMS8 1/20 0.44
SCN3A Q9NY46 3/20 0.43
SCN4A P35499 2/20 0.43
CYP17A1 P05093 1/20 0.42
TP53 P04637 1/20 0.41

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
SCHEMBL23610572 0.92 KMT2A (0.54) KMT2ALMNAHTTPOLBPKM
SCHEMBL23610573 0.88 SCN3A (0.44) KMT2ALMNAMAPTMEN1NPC1
SCHEMBL21296774 0.87 MAPT (0.46) KMT2ALMNAHTTPOLBPKM
SCHEMBL23610577 0.83 HSD17B1 (0.47) KMT2APOLBMEN1SCN3ASCN4A
SCHEMBL23610578 0.81 KMT2A (0.54) KMT2ALMNAHTTPOLBPKM
SCHEMBL21296781 0.78 MAPT (0.47) KMT2ALMNAPKMMAPTMEN1
SCHEMBL21296800 0.78 CNR1 (0.43) ALDH1A1SCN3ASCN4ACYP17A1
SCHEMBL21296842 0.76 BRAF (0.49) LMNAHTTMAPTKDM4ESMN1; SMN2
SCHEMBL21296839 0.73 PDK1 (0.48) KMT2ALMNAPOLBMEN1NPC1
SCHEMBL21296771 0.73 MAP2K4 (0.39) MAPTMEN1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530181-B2 IL-6 inhibitors and methods of treatment UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-12-20 US disclosed
US-11530181-B2 IL-6 inhibitors and methods of treatment UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-12-20 US disclosed
US-20210206718-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2021-07-08 US disclosed
US-20210206718-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2021-07-08 US disclosed
WO-2019165158-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2019-08-29 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 (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-11530181-B2 IL-6 inhibitors and methods of treatment IL6, IL6ST, IL2 KMT2A 2837/4885LMNA 4224/4885HTT 1486/4885
US-20210206718-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT IL6, IL6ST, IL2 KMT2A 2837/4885LMNA 4224/4885HTT 1486/4885

“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.