SCHEMBL30896325

SCHEMBL30896325

Cc1cc(-c2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)ccn1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.44
HTT P42858 5/20 0.44
LMNA P02545 4/20 0.44
KDM4E B2RXH2 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.40
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.38
PKM P14618 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MEN1 O00255 1/20 0.36
ADORA2B P29275 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
SCHEMBL30896315 0.84 MAPT (0.49) MAPTHTTLMNAKDM4ENPSR1
SCHEMBL30896312 0.81 KDM4E (0.40) MAPTHTTLMNAKDM4ENPSR1
SCHEMBL30896380 0.81 ALDH1A1 (0.40) MAPTHTTLMNAKDM4ESMN1; SMN2
SCHEMBL30896471 0.79 ADORA2A (0.41) MAPTHTTLMNAKDM4ENPSR1
SCHEMBL31613166 0.79 TRPA1 (0.37) MAPTHTTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL30896370 0.79 SCN9A (0.38) MAPTHTTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL30896396 0.79 ATAD2 (0.49) PDE3BPDE3A
SCHEMBL30896317 0.75 MAPK14 (0.47) KDM4EPDE3BPDE3ASMN1; SMN2ALDH1A1
SCHEMBL30896413 0.74 TDP1 (0.38) SMN1; SMN2ALDH1A1GAAPKML3MBTL1
SCHEMBL31613171 0.74 TDP1 (0.38) GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612128-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF HEMOGLOBINOPATHIES Bristol-Myers Squibb Company (US) 2025-09-10 EP disclosed
CN-120129677-A Compounds and their use for the treatment of heme lesions 百时美施贵宝公司 2025-06-10 CN disclosed
US-20250163025-A1 Compounds and Their Use for Treatment of Hemoglobinopathies BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-22 US disclosed
WO-2024097932-A1 COMPOUNDS AND THEIR USE FOR TREATMENT OF HEMOGLOBINOPATHIES BRISTOL-MYERS SQUIBB COMPANY (US) 2024-05-10 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-20250163025-A1 Compounds and Their Use for Treatment of Hemoglobinopathies HBG1, HBG2, HBB MAPT 4138/4885HTT 875/4885LMNA 319/4885

“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.