SCHEMBL5434835

SCHEMBL5434835

Nc1ccc2c(c1)c(Cl)nn2Cc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.51
▸ ACHE P22303 1/20 0.51
▸ CNR2 P34972 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ EGFR P00533 1/20 0.43
▸ GRM2 Q14416 1/20 0.41
▸ PTGER4 P35408 1/20 0.41
▸ SLC2A1 P11166 1/20 0.41
▸ MAOB P27338 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ RXFP1 Q9HBX9 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
SCHEMBL5431708 0.81 CNR2 (0.56) CNR1ACHECNR2PTGER4MAPT
SCHEMBL5297088 0.79 CNR1 (0.49) CNR1ACHECNR2SMN1; SMN2MAPT
SCHEMBL4028459 0.75 CNR1 (0.49) CNR1ACHECNR2L3MBTL1SLC2A1
SCHEMBL960723 0.74 SMN1; SMN2 (0.44) CNR1ACHECNR2L3MBTL1PTGER4
SCHEMBL215702 0.74 EGFR (0.53) EGFR
SCHEMBL30729935 0.74 EGFR (0.53) EGFR
SCHEMBL5433673 0.73 ALDH1A1 (0.44) L3MBTL1EGFRPTGER4SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL1353996 0.73 EGFR (0.52) EGFR
SCHEMBL5443607 0.71 KDM4C (0.39) CNR1ACHECNR2GRM2KMT2A
SCHEMBL3322212 0.71 CNR1 (0.64) CNR1ACHECNR2L3MBTL1SMN1; SMN2

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
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

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 CNR1 155/4885ACHE 58/4885CNR2 210/4885

“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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