SCHEMBL23605194

SCHEMBL23605194

COc1ccc(/C=C(\C#N)C(=O)O)c(O)c1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.60
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
KDM4E B2RXH2 2/20 0.57
LMNA P02545 1/20 0.57
PKM P14618 1/20 0.57
KMT2A Q03164 1/20 0.57
SLC16A3 O15427 7/20 0.56
SLC16A1 P53985 7/20 0.56
TRIM24 O15164 1/20 0.55
TYR P14679 1/20 0.55
TRIM33 Q9UPN9 1/20 0.55
MIF P14174 1/20 0.52

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
SCHEMBL8649661 0.87 CYP1A2 (0.78) CYP1A2CYP3A4CYP2C9KDM4ELMNA
SCHEMBL9360940 0.87 CYP1A2 (0.78) CYP1A2CYP3A4CYP2C9KDM4ELMNA
SCHEMBL3020681 0.87 CYP1A2 (0.58) EGFRCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL3020683 0.87 CYP1A2 (0.58) EGFRCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL28820627 0.86 CYP1A2 (0.56) EGFRCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL15428904 0.84 KDM4E (0.68) CYP1A2CYP3A4CYP2C9KDM4ELMNA
SCHEMBL21457392 0.83 EGFR (0.79) EGFRCYP3A4KDM4ELMNAPKM
SCHEMBL21457390 0.83 EGFR (0.79) EGFRCYP3A4KDM4ELMNAPKM
SCHEMBL17831051 0.81 KDM4E (0.68) EGFRCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL9358828 0.80 TRIM24 (0.60) CYP1A2CYP3A4KDM4ELMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802106-B2 Cathode buffer layer material and organic or organic/inorganic hybrid photoelectric device comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-10-31 US disclosed
US-20210198188-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-07-01 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-11802106-B2 Cathode buffer layer material and organic or organic/inorganic hybrid photoelectric device comprising same DCX, CDH1, CACNA2D3 EGFR 4368/4885CYP1A2 4259/4885CYP3A4 3086/4885
US-20210198188-A1 NOVEL CATHODE BUFFER LAYER MATERIAL AND ORGANIC OR ORGANIC/INORGANIC HYBRID PHOTOELECTRIC DEVICE COMPRISING SAME DCX, HCN3, CDH1 EGFR 4330/4885CYP1A2 4481/4885CYP3A4 3511/4885

“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.