SCHEMBL5307216

SCHEMBL5307216

O=[N+]([O-])c1ccc2c(c1)c(Cl)nn2CC1CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 5/20 0.48
▸ ACHE P22303 4/20 0.45
▸ CNR1 P21554 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KDM4C Q9H3R0 1/20 0.39
▸ MCHR1 Q99705 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLS O94925 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ATM Q13315 1/20 0.38

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
SCHEMBL5438052 0.95 CNR2 (0.52) CNR2ACHECNR1L3MBTL1MAPT
SCHEMBL22151026 0.81 MAPT (0.52) CNR2ACHECNR1L3MBTL1MAPT
SCHEMBL22151047 0.78 CNR2 (0.58) CNR2ACHECNR1L3MBTL1MAPT
SCHEMBL5443607 0.78 KDM4C (0.39) CNR2ACHECNR1KMT2AKDM4C
SCHEMBL5464933 0.77 CNR2 (0.46) CNR2ACHECNR1L3MBTL1MAPT
SCHEMBL6069615 0.77 CNR2 (0.58) CNR2ACHECNR1L3MBTL1LMNA
SCHEMBL23467039 0.76 KDM4C (0.40) CNR2ACHECNR1KMT2AKDM4C
SCHEMBL29770896 0.76 KDM4C (0.40) CNR2ACHECNR1KMT2AKDM4C
SCHEMBL22151034 0.75 CNR2 (0.44) CNR2ACHECNR1L3MBTL1MAPT
SCHEMBL5443540 0.75 CNR2 (0.55) CNR2ACHECNR1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101098857-A Nitro indazole derivatives ASTRAZENECA AB (SE) 2008-01-02 — — CN disclosed
US-20070265325-A1 Nitro Indazole Derivatives ASTRAZENECA AB (SE) 2007-11-15 — — US disclosed
US-20070265325-A1 Nitro Indazole Derivatives ASTRAZENECA AB (SE) 2007-11-15 — — US disclosed
US-20070265325-A1 Nitro Indazole Derivatives ASTRAZENECA AB (SE) 2007-11-15 — — US disclosed
EP-1814864-A1 NITRO INDAZOLE DERIVATIVES AstraZeneca AB (SE) 2007-08-08 — — EP disclosed
WO-2006052189-A1 NITRO INDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2006-05-18 — — 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-20070265325-A1 Nitro Indazole Derivatives NOS3, CYP3A43, NOS2 CNR2 210/4885ACHE 58/4885CNR1 155/4885

“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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