SCHEMBL21717824

SCHEMBL21717824

Cc1ccc(C#N)cc1-c1ccc2c(c1)c1cccc3c4ccccc4n2c31

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.41
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.35
FTO Q9C0B1 1/20 0.35
ENPP3 O14638 1/20 0.35
RORC P51449 9/20 0.35
ABL1 P00519 2/20 0.34
MAPK14 Q16539 1/20 0.34
BRD4 O60885 1/20 0.33
ALDH1A1 P00352 1/20 0.32
DUSP3 P51452 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
SCHEMBL21717870 0.91 ENPP3 (0.39) PTGER4CYP11B1CYP11B2ENPP3ABL1
SCHEMBL21717346 0.90 PTGER4 (0.37) PTGER4CYP11B1CYP11B2ALKBH5FTO
SCHEMBL21710702 0.88 CA1 (0.37) PTGER4CYP11B1CYP11B2ENPP3ABL1
SCHEMBL21710470 0.85 ENPP3 (0.40) PTGER4CYP11B1CYP11B2ENPP3RORC
SCHEMBL21710482 0.84 PTGER4 (0.38) PTGER4CYP11B1CYP11B2ENPP3RORC
SCHEMBL22858124 0.84 ENPP3 (0.38) PTGER4CYP11B1CYP11B2ENPP3RORC
SCHEMBL21710649 0.84 PTGER4 (0.39) PTGER4ALKBH5FTOENPP3RORC
SCHEMBL21710647 0.83 PTGER4 (0.41) PTGER4ENPP3RORC
SCHEMBL21717825 0.83 ENPP3 (0.43) PTGER4ENPP3RORCALDH1A1DUSP3
SCHEMBL38652911 0.83 ENPP3 (0.43) PTGER4ENPP3RORCALDH1A1DUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029119-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2024-07-02 US disclosed
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-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 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 (4 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-12029119-B2 Organic electroluminescence element and electronic device LEF1, L1CAM, ESR2 PTGER4 2157/4885CYP11B1 1468/4885CYP11B2 1438/4885
US-20200052225-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE LEF1, L1CAM, ESR2 PTGER4 2157/4885CYP11B1 1468/4885CYP11B2 1438/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 PTGER4 3243/4885CYP11B1 1193/4885CYP11B2 705/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 PTGER4 4325/4885CYP11B1 2860/4885CYP11B2 2600/4885

“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.