SCHEMBL5101139

SCHEMBL5101139

O=C1NC(NC2CCC(O)CC2)=N/C1=C\c1c[nH]c2ncccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 2/20 0.46
▸ CHEK1 O14757 4/20 0.46
▸ KMT2A Q03164 1/20 0.43
▸ CDC7 O00311 12/20 0.43
▸ CDK9 P50750 4/20 0.43
▸ CDK1 P06493 3/20 0.43
▸ CSNK2A1 P68400 3/20 0.43
▸ MAPK13 O15264 2/20 0.43
▸ PDPK1 O15530 2/20 0.43
▸ DAPK3 O43293 2/20 0.43
▸ DYRK3 O43781 2/20 0.43
▸ JAK2 O60674 2/20 0.43
▸ PRKD3 O94806 2/20 0.43
▸ PAK4 O96013 2/20 0.43
▸ EGFR P00533 2/20 0.43
▸ PRKCG P05129 2/20 0.43
▸ FES P07332 2/20 0.43
▸ CSF1R P07333 2/20 0.43
▸ ROS1 P08922 2/20 0.43
▸ PIM1 P11309 2/20 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
SCHEMBL5101151 1.00 RET (0.46) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL5092675 0.95 CHEK1 (0.48) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL5092665 0.95 CHEK1 (0.48) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL4765326 0.91 CHEK1 (0.47) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL4765336 0.91 CHEK1 (0.47) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL4901349 0.90 CHEK1 (0.44) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL4901351 0.90 CHEK1 (0.44) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL5094688 0.90 CDC7 (0.48) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL5094673 0.90 CDC7 (0.48) RETCHEK1KMT2ACDC7CDK9
Hydrochloric Acid SCHEMBL5089798 0.90 CDC7 (0.48) RETCHEK1KMT2ACDC7CDK9

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
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 — — US claimed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 — — US claimed
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 — — US disclosed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 — — 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-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K6, MAP3K1 RET 330/4885CHEK1 251/4885KMT2A 1112/4885

“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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