SCHEMBL1307975

SCHEMBL1307975

O=C(O)c1cc(I)ccc1NC(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ RXFP1 Q9HBX9 1/20 0.55
▸ PTPRC P08575 2/20 0.55
▸ PTPN2 P17706 1/20 0.55
▸ PTPN1 P18031 1/20 0.55
▸ PTPRA P18433 1/20 0.55
▸ PTPRB P23467 1/20 0.55
▸ PTPRE P23469 1/20 0.55
▸ PTPN6 P29350 1/20 0.55
▸ KCNK3 O14649 2/20 0.53
▸ KCNK9 Q9NPC2 2/20 0.53
▸ LMNA P02545 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ PTGS1 P23219 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CA12 O43570 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ AKR1C3 P42330 1/20 0.47

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
SCHEMBL1307523 0.85 MEN1 (0.59) MEN1KMT2ARXFP1KCNK3KCNK9
SCHEMBL1307808 0.85 KDM4E (0.64) MEN1KMT2ARXFP1LMNAKDM4E
SCHEMBL1309690 0.82 PTPRC (0.59) MEN1KMT2APTPRCPTPN2PTPN1
SCHEMBL1309719 0.81 PTPRC (0.62) MEN1KMT2ARXFP1PTPRCPTPN2
SCHEMBL1308617 0.79 PTPRC (0.59) MEN1KMT2ARXFP1PTPRCPTPN2
SCHEMBL1308363 0.79 CYP1A2 (0.59) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL1307027 0.79 PTPRC (0.59) MEN1KMT2APTPRCPTPN2PTPN1
SCHEMBL14075414 0.78 MEN1 (0.70) MEN1KMT2APTPRCPTPN2PTPN1
SCHEMBL15925029 0.78 RXFP1 (0.57) MEN1KMT2ARXFP1PTPRCKCNK3
SCHEMBL2274690 0.77 ACLY (0.61) MEN1KMT2ARXFP1KCNK3KCNK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2009-02-12 — — US claimed
EP-1940792-A2 AMINOPYRIMIDINE, AMINOPYRIDINE AND ANILINE DERIVATIVES INHIBITORS OF PIM-1 AND/OR PIM-3 Exelixis, Inc. (US) 2008-07-09 — — EP claimed
WO-2007044724-A2 AMINOPYRIMIDINE, AMINOPYRIDINE AND ANILINE DERIVATIVES INHIBITORS OF PIM-I AND/OR PIM-3 EXELIXIS, INC. (US) 2007-04-19 — — WO claimed
WO-2004022525-A1 AMIDE DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 — — WO claimed
US-8053454-B2 Pyridopyrimidinone inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2011-11-08 — — US disclosed
US-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2009-02-12 — — US disclosed
WO-2004022525-A1 AMIDE DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 — — 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-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 PIM1, PIM3, PIM2 MEN1 2312/4885KMT2A 1570/4885RXFP1 1619/4885

“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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