SCHEMBL1203520

SCHEMBL1203520

Cc1cc(Cl)nn2c(C(=O)Nc3ccccc3)cnc12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 6/20 0.47
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ RPS6KB1 P23443 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ EGFR P00533 1/20 0.42
▸ TYK2 P29597 1/20 0.42
▸ DHODH Q02127 1/20 0.41
▸ TSHR P16473 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
SCHEMBL19554476 0.81 RAB9A (0.55) MAPTSMN1; SMN2NPC1RAB9AHPGD
SCHEMBL2908834 0.80 ALDH1A1 (0.37) NR3C1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL1203241 0.79 FYN (0.45) NR3C1MAPTDHODH
SCHEMBL1202146 0.78 NPC1 (0.43) NR3C1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL1203470 0.77 KCNQ3 (0.46) SMN1; SMN2NPC1RAB9AEGFRDHODH
SCHEMBL3721289 0.77 ROCK2 (0.47) MEN1KMT2ATYK2
SCHEMBL19554627 0.75 IDO1 (0.41) NR3C1NPC1RAB9ATYK2
SCHEMBL19554639 0.75 IDO1 (0.41) NR3C1NPC1RAB9ATYK2
SCHEMBL19554626 0.75 IDO1 (0.41) NR3C1NPC1RAB9ATYK2
SCHEMBL3722056 0.75 ROCK2 (0.43) NR3C1NPC1MEN1KMT2ATYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2011-02-24 — — US disclosed
EP-2217601-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS Centro Nacional de Investigaciones Oncológicas (CNIO) (ES) 2010-08-18 — — EP disclosed
WO-2009060197-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2009-05-14 — — 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-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors PIM1, PIM3, PIM2 NR3C1 2295/4885MAPT 3988/4885SMN1; SMN2 4097/4885

“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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