SCHEMBL25602298

SCHEMBL25602298

O=[N+]([O-])c1ccc(C2Nc3c(ccc(Cl)c3Cl)C3C=CCC32)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A1 P22736 7/20 0.66
▸ HPN P05981 2/20 0.66
▸ USP7 Q93009 2/20 0.55
▸ CYBB P04839 1/20 0.53
▸ HSPD1 P10809 1/20 0.48
▸ HSPE1 P61604 1/20 0.48
▸ FPR1 P21462 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ PSD A5PKW4 1/20 0.48
▸ POLB P06746 4/20 0.44
▸ MAPT P10636 3/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ GAPDH P04406 1/20 0.43
▸ HSPA1A P0DMV8 1/20 0.43
▸ HSPA8 P11142 1/20 0.43
▸ CD44 P16070 1/20 0.43
▸ MSN P26038 1/20 0.43

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
SCHEMBL25602305 0.89 NR4A1 (0.72) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL17712445 0.82 HPN (0.76) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL15494257 0.80 HPN (0.71) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL13856218 0.80 NR4A1 (1.00) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL2035383 0.80 HPN (1.00) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL25602307 0.77 USP7 (0.87) NR4A1HPNUSP7CYBBPOLB
SCHEMBL5993985 0.77 NR4A1 (0.79) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL10036595 0.76 PTPN1 (0.61) NR4A1HPNUSP7CYBBHSPD1
SCHEMBL25602301 0.76 USP7 (0.80) NR4A1HPNUSP7CYBBFPR1
SCHEMBL25602302 0.75 USP7 (0.57) NR4A1HPNUSP7CYBBFPR1

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-11672794-B2 Therapeutic targeting of the BAP1 complex in cancer NORTHWESTERN UNIVERSITY (US) 2023-06-13 — — 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-11672794-B2 Therapeutic targeting of the BAP1 complex in cancer BAP1, MCL1, STUB1 NR4A1 3392/4885HPN 1581/4885USP7 113/4885

“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.

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