SCHEMBL29454129

SCHEMBL29454129

COc1cc(N)c(C)c(Nc2ccccc2OC(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
EPHX2 P34913 1/20 0.39
MAPT P10636 3/20 0.38
RECQL P46063 2/20 0.38
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 3/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
HTT P42858 1/20 0.37
MMP14 P50281 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL22232236 1.00 PTPN11 (0.40) PTPN11AKR1C3AKR1C2EPHX2MAPT
SCHEMBL29454212 0.86 AKR1C3 (0.51) PTPN11AKR1C3AKR1C2MAPTRECQL
SCHEMBL31723197 0.86 AKR1C3 (0.51) PTPN11AKR1C3AKR1C2MAPTRECQL
SCHEMBL22232473 0.86 AKR1C3 (0.51) PTPN11AKR1C3AKR1C2MAPTRECQL
SCHEMBL29454086 0.84 EPHX2 (0.40) PTPN11EPHX2MAPTRECQLDUSP3
SCHEMBL22232113 0.84 EPHX2 (0.40) PTPN11EPHX2MAPTRECQLDUSP3
SCHEMBL22232656 0.83 CXCR2 (0.42) PTPN11EPHX2MAPTRECQLDUSP3
SCHEMBL29454258 0.83 CXCR2 (0.42) PTPN11EPHX2MAPTRECQLDUSP3
SCHEMBL22232328 0.80 PTPN11 (0.35) PTPN11AKR1C3AKR1C2EPHX2ALDH1A1
SCHEMBL22232330 0.80 PTPN11 (0.35) PTPN11AKR1C3AKR1C2EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545639-B2 3-substituted phenylamidine compounds, preparation and use thereof PI INDUSTRIES LTD. (IN) 2026-02-10 US claimed
EP-4647426-A2 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2025-11-12 EP claimed
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 US claimed
US-12545639-B2 3-substituted phenylamidine compounds, preparation and use thereof PI INDUSTRIES LTD. (IN) 2026-02-10 US disclosed
EP-4647426-A2 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2025-11-12 EP disclosed
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 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 (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-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF H1-3, PRMT7, PFAS PTPN11 3561/4885AKR1C3 336/4885AKR1C2 1214/4885
US-12545639-B2 3-substituted phenylamidine compounds, preparation and use thereof CBR1, CBR3, HCCS PTPN11 976/4885AKR1C3 42/4885AKR1C2 101/4885

“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.