SCHEMBL21717404

SCHEMBL21717404

N#Cc1ccc(-c2ccc3c(c2)c2cc4ccccc4c4c5ccccc5n3c24)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
PTGER4 P35408 1/20 0.37
PDPK1 O15530 1/20 0.37
PGR P06401 1/20 0.37
HDAC8 Q9BY41 1/20 0.34
RORC P51449 4/20 0.33
MAP4K4 O95819 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
TNKS O95271 1/20 0.33
CHEK1 O14757 1/20 0.32
ALDH1A3 P47895 1/20 0.32
KIF11 P52732 1/20 0.32
ICMT O60725 1/20 0.32

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
SCHEMBL21717866 0.95 ENPP3 (0.40) ENPP3CA1CA2PTGER4PDPK1
SCHEMBL21710663 0.90 ALDH1A3 (0.39) ENPP3CA1CA2PGRMAP4K4
SCHEMBL21710700 0.90 CA1 (0.44) ENPP3CA1CA2PTGER4PDPK1
SCHEMBL21717841 0.87 TSPO (0.38) MEN1KMT2A
SCHEMBL21717407 0.87 TSPO (0.38) MEN1KMT2A
SCHEMBL22679283 0.86 PTGER4 (0.35) ENPP3CA1CA2PTGER4PDPK1
SCHEMBL22679274 0.85 ENPP3 (0.39) ENPP3CA1CA2PGRMAP4K4
SCHEMBL21718127 0.84 ENPP3 (0.46) ENPP3CA1CA2PTGER4PDPK1
SCHEMBL21718109 0.84 TSPO (0.36)
SCHEMBL21710664 0.84 PTGES (0.32) KMT2A

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-11723272-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-08-08 US disclosed
US-11723272-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-08-08 US disclosed
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20200365812-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-11-19 US disclosed
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 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 (3 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-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE LEF1, L1CAM, ESR2 ENPP3 2110/4885CA1 2666/4885CA2 1903/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 ENPP3 2238/4885CA1 2333/4885CA2 2351/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 ENPP3 3165/4885CA1 2980/4885CA2 3016/4885

“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.