SCHEMBL21593638

SCHEMBL21593638

O=C(/C=C/c1ccccc1)Nc1c(F)cccc1F

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 13/20 0.71
MMP2 P08253 13/20 0.71
MMP9 P14780 13/20 0.71
EGFR P00533 10/20 0.71
ALDH1A1 P00352 1/20 0.68
MAOA P21397 1/20 0.62
MAOB P27338 1/20 0.62
HDAC3 O15379 1/20 0.58
HDAC4 P56524 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC2 Q92769 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
DEGS1 O15121 1/20 0.55

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
N-(2-Fluorophenyl)Cinnamamide SCHEMBL1967609 0.83 MMP1 (1.00) MMP1MMP2MMP9EGFRALDH1A1
N-(2-Fluorophenyl)Cinnamamide SCHEMBL1967607 0.83 MMP1 (1.00) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL705904 0.83 MMP1 (0.80) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL705905 0.83 MMP1 (0.80) MMP1MMP2MMP9EGFRALDH1A1
SCHEMBL11576171 0.81 MMP1 (0.71) MMP1MMP2MMP9EGFRMAOA
SCHEMBL11575343 0.81 MMP1 (0.71) MMP1MMP2MMP9EGFRMAOA
SCHEMBL2821162 0.80 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOA
SCHEMBL3180639 0.80 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOA
SCHEMBL2819695 0.80 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOA
SCHEMBL30159590 0.80 MMP1 (0.76) MMP1MMP2MMP9EGFRMAOA

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-20210207175-A1 COMPOUND FOR REGULATING GENE EDITING EFFICIENCY AND APPLICATION THEREOF SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2021-07-08 US disclosed
EP-3825409-A1 COMPOUND FOR REGULATING GENE EDITING EFFICIENCY AND APPLICATION THEREOF Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2021-05-26 EP disclosed
WO-2019238091-A1 COMPOUND FOR REGULATING GENE EDITING EFFICIENCY AND APPLICATION THEREOF 中国科学院上海有机化学研究所 2019-12-19 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-20210207175-A1 COMPOUND FOR REGULATING GENE EDITING EFFICIENCY AND APPLICATION THEREOF TET2, ZFX, ZFR MMP1 4552/4885MMP2 3182/4885MMP9 3257/4885

“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.