SCHEMBL3523816

SCHEMBL3523816

O=C(O)c1cc(Cl)nnc1Nc1ccc(I)cc1F

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 Q02750 15/20 0.54
▸ MAP2K2 P36507 10/20 0.54
▸ IDO1 P14902 1/20 0.51
▸ DHODH Q02127 1/20 0.43
▸ PTPRC P08575 1/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPRA P18433 1/20 0.40
▸ PTPRB P23467 1/20 0.40
▸ PTPRE P23469 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ AURKA O14965 1/20 0.39
▸ PRKCB P05771 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ TNFRSF1A P19438 1/20 0.39
▸ STK3 Q13188 1/20 0.39

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
SCHEMBL3525526 0.89 MAP2K1 (0.55) MAP2K1MAP2K2IDO1
SCHEMBL3523857 0.81 MAP2K1 (0.51) MAP2K1MAP2K2IDO1DHODH
SCHEMBL1571730 0.80 MAP2K1 (0.54) MAP2K1MAP2K2IDO1PTPRCPTPN2
SCHEMBL13119544 0.77 MAP2K1 (0.65) MAP2K1MAP2K2
SCHEMBL12129602 0.77 MAP2K1 (0.56) MAP2K1MAP2K2IDO1
SCHEMBL3527300 0.76 MAP2K1 (0.60) MAP2K1MAP2K2IDO1DHODHPTPRC
SCHEMBL3529174 0.76 IDO1 (0.48) MAP2K1MAP2K2IDO1
SCHEMBL13119546 0.75 BCL3 (0.49) —
SCHEMBL23851383 0.74 MAP2K1 (0.59) MAP2K1MAP2K2IDO1DHODHAURKA
SCHEMBL31135614 0.74 MAP2K1 (0.59) MAP2K1MAP2K2IDO1DHODHAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772233-B2 Arylamino N-heteroaryl compounds as MEK inhibitors Merck Serono, S.A. (CH) 2010-08-10 — — US claimed
US-20070287709-A1 Novel arylamino N-heteraryls as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 — — US claimed
WO-2007123939-A2 NOVEL ARYLAMINO N-HETERARYLS AS MEK INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-11-01 — — WO claimed
US-8802703-B2 Arylamino N-heteraryl compounds as MEK inhibitors MERCK SERONO S.A. (CH) 2014-08-12 — — US disclosed
US-8802703-B2 Arylamino N-heteraryl compounds as MEK inhibitors MERCK SERONO S.A. (CH) 2014-08-12 — — US disclosed
US-8802703-B2 Arylamino N-heteraryl compounds as MEK inhibitors MERCK SERONO S.A. (CH) 2014-08-12 — — US disclosed
US-20100256149-A1 NOVEL ARYLAMINO N-HETERARYL COMPOUNDS AS MEK INHIBITORS MERCK SERONO S.A. (CH) 2010-10-07 — — US disclosed
US-20100256149-A1 NOVEL ARYLAMINO N-HETERARYL COMPOUNDS AS MEK INHIBITORS MERCK SERONO S.A. (CH) 2010-10-07 — — US disclosed
US-20100256149-A1 NOVEL ARYLAMINO N-HETERARYL COMPOUNDS AS MEK INHIBITORS MERCK SERONO S.A. (CH) 2010-10-07 — — US disclosed
US-7772233-B2 Arylamino N-heteroaryl compounds as MEK inhibitors Merck Serono, S.A. (CH) 2010-08-10 — — US disclosed
US-7772233-B2 Arylamino N-heteroaryl compounds as MEK inhibitors Merck Serono, S.A. (CH) 2010-08-10 — — US disclosed
US-7772233-B2 Arylamino N-heteroaryl compounds as MEK inhibitors Merck Serono, S.A. (CH) 2010-08-10 — — US disclosed
US-20070287709-A1 Novel arylamino N-heteraryls as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 — — US disclosed
US-20070287709-A1 Novel arylamino N-heteraryls as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 — — US disclosed
US-20070287709-A1 Novel arylamino N-heteraryls as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 — — US disclosed
WO-2007123939-A2 NOVEL ARYLAMINO N-HETERARYLS AS MEK INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-11-01 — — 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 (2 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-20100256149-A1 NOVEL ARYLAMINO N-HETERARYL COMPOUNDS AS MEK INHIBITORS NRAS, MAP3K19, MAP3K20 MAP2K1 50/4885MAP2K2 42/4885IDO1 1079/4885
US-20070287709-A1 Novel arylamino N-heteraryls as MEK inhibitors NRAS, MAP3K19, MAP3K1 MAP2K1 48/4885MAP2K2 39/4885IDO1 985/4885

“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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