Sugi Predict

Sugi Predict / Compounds / SCHEMBL63114

SCHEMBL63114

SCHEMBL63114

COc1cc(CCc2cc(NC(=O)c3cccc(OC)c3)n[nH]2)cc(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR2 P21802 6/20 0.62
▸ FGFR1 P11362 2/20 0.62
▸ FGFR4 P22455 2/20 0.62
▸ FGFR3 P22607 1/20 0.62
▸ NTRK1 P04629 1/20 0.62
▸ RET P07949 1/20 0.62
▸ PDGFRB P09619 1/20 0.62
▸ MARK3 P27448 1/20 0.62
▸ TNK2 Q07912 1/20 0.62
▸ DDR1 Q08345 1/20 0.62
▸ MAP4K2 Q12851 1/20 0.62
▸ MAP3K11 Q16584 1/20 0.62
▸ DDR2 Q16832 1/20 0.62
▸ MARK2 Q7KZI7 1/20 0.62
▸ MAP4K3 Q8IVH8 1/20 0.62
▸ MAP4K1 Q92918 1/20 0.62
▸ AURKB Q96GD4 1/20 0.62
▸ EIF2AK1 Q9BQI3 1/20 0.62
▸ MAP3K20 Q9NYL2 1/20 0.62
▸ STK26 Q9P289 1/20 0.62

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
SCHEMBL23409092 0.92 FGFR2 (0.60) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL21430743 0.91 FGFR1 (0.67) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL4553948 0.90 FGFR1 (0.55) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL25068960 0.89 FGFR2 (0.58) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL23409091 0.86 FGFR1 (0.68) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL21431007 0.85 FGFR2 (0.71) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL25649692 0.85 FGFR1 (0.67) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL63624 0.83 FGFR1 (0.65) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL25068999 0.83 FGFR1 (0.65) FGFR2FGFR1FGFR4FGFR3NTRK1
SCHEMBL63550 0.83 FGFR1 (0.65) FGFR2FGFR1FGFR4FGFR3NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125748-B1 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2011-05-25 — — EP claimed
US-10301267-B2 Compounds ASTRAZENECA AB (SE) 2019-05-28 — — US disclosed
US-20170260143-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2017-09-14 — — US disclosed
US-9688640-B2 Methods of treating cancer with a pyrazole derivative ASTRAZENECA AB (SE) 2017-06-27 — — US disclosed
US-20150299134-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2015-10-22 — — US disclosed
US-20140066455-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2014-03-06 — — US disclosed
US-8604022-B2 N-[5-[2-(3,5-dimethoxyphenyl)ethyl]-1h-pyrazol-3-yl]-4-(3,4-dimethylpiperazin-1-yl)benzamide and salts thereof ASTRAZENECA AB (SE) 2013-12-10 — — US disclosed
US-20120129844-A1 N-[5-[2-(3,5-DIMETHOXYPHENYL)ETHYL]-1H-PYRAZOL-3-YL]-4-(3,4-DIMETHYLPIPERAZIN-1-YL)BENZAMIDE AND SALTS THEREOF ASTRAZENECA AB 2012-05-24 — — US disclosed
US-8129391-B2 N-[5-[2-(3,5-Dimethoxyphenyl)ethyl]-1H-pyrazol-3-yl]-4-(3,4-dimethylpiperazin-1-yl)benzamide and salts thereof ASTRAZENECA AB (SE) 2012-03-06 — — US disclosed
EP-2125748-B1 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2011-05-25 — — EP disclosed
US-20100273811-A1 N-[5-[2-(3,5-Dimethoxyphenyl)ethyl]-1H-pyrazol-3-yl]-4-(3,4-dimethylpiperazin-1-yl)benzamide and Salts Thereof ASTRAZENECA AB 2010-10-28 — — US disclosed
US-7737149-B2 N-[5-[2-(3,5-dimethoxyphenyl)ethyl]-2H-pyrazol-3-yl]-4-(3,5-dimethylpiperazin-1-yl)benzamide and salts thereof ASTRAZENECA AB (SE) 2010-06-15 — — US disclosed
US-20080153812-A1 Heterocyclic amides as anticancer agents ASTRAZENECA AB (SE) 2008-06-26 — — 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 (7 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-10301267-B2 Compounds SLC10A1, CYP11B1, ABCB11 FGFR2 688/4885FGFR1 333/4885FGFR4 758/4885
US-20100273811-A1 N-[5-[2-(3,5-Dimethoxyphenyl)ethyl]-1H-pyrazol-3-yl]-4-(3,4-dimethylpiperazin-1-yl)benzamide and Salts Thereof PKD1, SDHA, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 FGFR2 939/4885FGFR1 823/4885FGFR4 719/4885
US-20140066455-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 FGFR2 755/4885FGFR1 238/4885FGFR4 864/4885
US-20080153812-A1 Heterocyclic amides as anticancer agents HDAC1, HDAC11, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 FGFR2 603/4885FGFR1 168/4885FGFR4 585/4885
US-20120129844-A1 N-[5-[2-(3,5-DIMETHOXYPHENYL)ETHYL]-1H-PYRAZOL-3-YL]-4-(3,4-DIMETHYLPIPERAZIN-1-YL)BENZAMIDE AND SALTS THEREOF PKD1, SDHA, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 FGFR2 939/4885FGFR1 823/4885FGFR4 719/4885
US-20170260143-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 FGFR2 755/4885FGFR1 238/4885FGFR4 864/4885
US-20150299134-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 FGFR2 755/4885FGFR1 238/4885FGFR4 864/4885

“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.