SCHEMBL17736238

SCHEMBL17736238

COc1cc(OC)c(Cl)c(N(C(=O)OC(C)(C)C)C(=O)N(C)c2cc(N(C(=O)OC(C)(C)C)c3ccc(C(=O)N4CCN(C)CC4)cc3[N+](=O)[O-])ncn2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.41
▸ ALDH1A1 P00352 11/20 0.39
▸ MAPT P10636 5/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ HTT P42858 4/20 0.37
▸ MITF O75030 1/20 0.37
▸ TNF P01375 1/20 0.37
▸ NOD1 Q9Y239 1/20 0.37
▸ FGFR3 P22607 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSP90AA1 P07900 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PDE5A O76074 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPC1 O15118 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
SCHEMBL17728832 0.96 FGFR1 (0.41) FGFR1ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL17728831 0.96 FGFR1 (0.41) FGFR1ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL17736237 0.89 FGFR1 (0.43) FGFR1FGFR3CYP3A4CYP2C9CYP2C19
SCHEMBL17728880 0.88 HCAR3 (0.39) ALDH1A1MAPTSMN1; SMN2GAAMEN1
SCHEMBL16659558 0.88 ALDH1A1 (0.36) ALDH1A1MAPTSMN1; SMN2HTTGAA
SCHEMBL16659488 0.85 FGFR1 (0.39) FGFR1ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL17736232 0.85 KDM4E (0.32) ALDH1A1MAPTGAAMAPK1LMNA
SCHEMBL17728845 0.85 FGFR1 (0.42) FGFR1FGFR3CYP3A4CYP2C9CYP2C19
SCHEMBL17736239 0.85 FGFR1 (0.58) FGFR1FGFR3
SCHEMBL16665243 0.83 FGFR1 (0.36) FGFR1ALDH1A1MAPTSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170360785-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-12-21 — — US disclosed
US-20170360785-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-12-21 — — US disclosed
US-9730931-B2 Pyrimidine FGFR4 inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-08-15 — — US disclosed
US-9730931-B2 Pyrimidine FGFR4 inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-08-15 — — US disclosed
US-20170007601-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-01-12 — — US disclosed
US-20170007601-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-01-12 — — US disclosed
US-9434697-B2 Pyrimidine FGFR4 inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-09-06 — — US disclosed
US-9434697-B2 Pyrimidine FGFR4 inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-09-06 — — US disclosed
US-20160130237-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-05-12 — — US disclosed
US-20160130237-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-05-12 — — 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 (3 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-20170360785-A1 PYRIMIDINE FGFR4 INHIBITORS FGFR4, FGFR1, FGFR3 FGFR1 2/4885ALDH1A1 1012/4885MAPT 3917/4885
US-20160130237-A1 PYRIMIDINE FGFR4 INHIBITORS FGFR4, FGFR1, FGFR3 FGFR1 2/4885ALDH1A1 1012/4885MAPT 3917/4885
US-20170007601-A1 PYRIMIDINE FGFR4 INHIBITORS FGFR4, FGFR1, FGFR3 FGFR1 2/4885ALDH1A1 1012/4885MAPT 3917/4885

“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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