SCHEMBL5095372

SCHEMBL5095372

O=C1NC(NCc2cc(F)cc(C(F)(F)F)c2)(OC(=O)C(F)(F)F)NC1=Cc1c[nH]c2ncccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 2/20 0.38
▸ NTRK3 Q16288 1/20 0.38
▸ NTRK2 Q16620 1/20 0.38
▸ GSK3B P49841 2/20 0.37
▸ CHEK1 O14757 2/20 0.36
▸ CHEK2 O96017 1/20 0.36
▸ CDK1 P06493 1/20 0.36
▸ SRC P12931 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ HASPIN Q8TF76 4/20 0.34
▸ CCNT1 O60563 2/20 0.34
▸ CDK9 P50750 2/20 0.34
▸ TACR1 P25103 1/20 0.34
▸ CDC7 O00311 5/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ ROCK2 O75116 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ PIM1 P11309 1/20 0.33

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
SCHEMBL5089778 0.76 HASPIN (0.41) CHEK1CHEK2CDK1SRCCSNK2A2
SCHEMBL5092742 0.75 CHEK1 (0.39) NTRK1CHEK1CHEK2CDK1SRC
Trifluoroacetic Acid SCHEMBL5095364 0.75 NTRK1 (0.41) NTRK1NTRK3NTRK2GSK3BCHEK1
Trifluoroacetic Acid SCHEMBL5095375 0.75 NTRK1 (0.41) NTRK1NTRK3NTRK2GSK3BCHEK1
SCHEMBL5092907 0.73 RET (0.38) CHEK1CHEK2CDK1SRCCSNK2A2
Hydrochloric Acid SCHEMBL5101125 0.73 CDC7 (0.36) CHEK1CHEK2CDK1SRCCSNK2A2
Hydrochloric Acid SCHEMBL5095503 0.73 CDC7 (0.36) CHEK1CHEK2CDK1SRCCSNK2A2
Hydrochloric Acid SCHEMBL5092758 0.72 HTR3A (0.36) CHEK1CHEK2CDK1SRCCSNK2A2
SCHEMBL5094471 0.72 CNR1 (0.34) CHEK1CHEK2CDK1SRCCSNK2A2
Hydrochloric Acid SCHEMBL5089590 0.72 CDC7 (0.37) GSK3BCHEK1CHEK2CDK1HASPIN

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-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

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 NTRK1 835/4885NTRK3 1009/4885NTRK2 1388/4885

“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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