SCHEMBL26259796

SCHEMBL26259796

COc1c(C#N)ccc2cc(C#N)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
HPGDS O60760 2/20 0.39
IMPDH2 P12268 2/20 0.39
IMPDH1 P20839 2/20 0.39
GAK O14976 2/20 0.39
RIPK2 O43353 2/20 0.39
COQ8A Q8NI60 2/20 0.39
NLK Q9UBE8 2/20 0.39
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
AR P10275 2/20 0.36
SLC6A4 P31645 2/20 0.35

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
SCHEMBL26259810 0.80 IMPDH2 (0.48) IMPDH2IMPDH1KDM4EUSP2ALDH1A1
SCHEMBL26259763 0.77 CA1 (0.43) NCEH1CA1CA2IMPDH2IMPDH1
SCHEMBL24476762 0.77 IMPDH2 (0.53) CA1CA2IMPDH2IMPDH1KDM4E
SCHEMBL2905022 0.77 GAK (0.47) NCEH1CA1HPGDSGAKRIPK2
SCHEMBL13037656 0.75 CA2 (0.55) NCEH1CA1CA2IMPDH2IMPDH1
SCHEMBL5695734 0.75 AR (0.47) HPGDSIMPDH2IMPDH1KDM4EUSP2
SCHEMBL28313760 0.74 GAK (0.43) GAKRIPK2COQ8ANLKKDM4E
SCHEMBL31264065 0.74 CA1 (0.49) CA1CA2HPGDSKDM4EALDH1A1
SCHEMBL12320904 0.73 CA2 (0.53) NCEH1CA1CA2IMPDH2IMPDH1
SCHEMBL12310183 0.73 CA2 (0.53) NCEH1CA1CA2IMPDH2IMPDH1

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-20230287262-A1 PHOTON UPCONVERSION COMPOSITION, FILM, METHOD FOR CONVERTING VISIBLE LIGHT INTO ULTRAVIOLET LIGHT, AND COMPOUND KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2023-09-14 US disclosed
US-20230287262-A1 PHOTON UPCONVERSION COMPOSITION, FILM, METHOD FOR CONVERTING VISIBLE LIGHT INTO ULTRAVIOLET LIGHT, AND COMPOUND KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2023-09-14 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 (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-20230287262-A1 PHOTON UPCONVERSION COMPOSITION, FILM, METHOD FOR CONVERTING VISIBLE LIGHT INTO ULTRAVIOLET LIGHT, AND COMPOUND NUDC, CCNL2, SPIN3 NCEH1 3697/4885CA1 3875/4885CA2 4554/4885

“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.