SCHEMBL22232113

SCHEMBL22232113

Cc1c(N)cc(F)cc1Nc1ccccc1OC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.40
C1R P00736 1/20 0.38
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
P2RX7 Q99572 1/20 0.35
RECQL P46063 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN5 P54829 1/20 0.34
PTPN11 Q06124 1/20 0.34
TTK P33981 1/20 0.34
CXCR2 P25025 1/20 0.34
IGF1R P08069 1/20 0.33
AURKA O14965 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
CA2 P00918 1/20 0.33
MAP2K1 Q02750 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
SCHEMBL29454086 1.00 EPHX2 (0.40) EPHX2C1RGAAMAPTALDH1A1
SCHEMBL29454258 0.85 CXCR2 (0.42) EPHX2C1RGAAMAPTP2RX7
SCHEMBL22232656 0.85 CXCR2 (0.42) EPHX2C1RGAAMAPTP2RX7
SCHEMBL29454129 0.84 PTPN11 (0.40) EPHX2C1RGAAMAPTALDH1A1
SCHEMBL22232236 0.84 PTPN11 (0.40) EPHX2C1RGAAMAPTALDH1A1
SCHEMBL22232266 0.78 CCNC (0.40) GAAMAPTALDH1A1RECQL
SCHEMBL29454339 0.78 CCNC (0.40) GAAMAPTALDH1A1RECQL
SCHEMBL22232279 0.78 MAPK13 (0.43) ALDH1A1MAPK1L3MBTL1
SCHEMBL29454099 0.78 CCNC (0.40) GAAMAPTALDH1A1RECQL
SCHEMBL4057926 0.78 EPHX2 (0.49) EPHX2C1RGAAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2022-03-24 US claimed
EP-3911629-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2021-11-24 EP claimed
WO-2020148617-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI INDUSTRIES LTD. (IN) 2020-07-23 WO claimed

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-20220089523-A1 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF H1-3, PRMT7, PFAS EPHX2 1896/4885C1R 21/4885GAA 1080/4885

“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.