SCHEMBL21710708

SCHEMBL21710708

N#Cc1ccc(-c2cc3c4ccccc4n4c5ccc6ccccc6c5c(c2)c34)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
PDPK1 O15530 1/20 0.39
ENPP3 O14638 1/20 0.37
PTGER4 P35408 2/20 0.37
PTGES O14684 1/20 0.34
PGR P06401 1/20 0.34
MMP3 P08254 2/20 0.33
SCN7A Q01118 1/20 0.33
HSD11B1 P28845 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
RORC P51449 3/20 0.33
SLC22A12 Q96S37 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL22679280 0.89 CA1 (0.41) CA1CA2PDPK1ENPP3PTGER4
SCHEMBL21717829 0.88 CA1 (0.38) CA1CA2ENPP3PGRMEN1
SCHEMBL21717834 0.88 CA1 (0.40) CA1CA2PDPK1ENPP3PTGER4
SCHEMBL21710472 0.87 PTGES (0.38) PTGESMEN1KMT2A
SCHEMBL21710574 0.87 PTGER4 (0.40) CA1CA2ENPP3PTGER4MMP3
SCHEMBL21710705 0.86 PTGES (0.36) PTGESMEN1KMT2A
SCHEMBL21710474 0.84 PTGES (0.35) PTGESMEN1KMT2A
SCHEMBL21717866 0.84 ENPP3 (0.40) CA1CA2PDPK1ENPP3PTGER4
SCHEMBL21718058 0.84 ENPP3 (0.42) CA1CA2PDPK1ENPP3PTGER4
SCHEMBL21710479 0.83 HPRT1 (0.35) PTGESATM

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-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
US-20200052212-A1 ORGANIC ELECTROLUMINESCENT 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 CA1 2666/4885CA2 1903/4885PDPK1 2901/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 CA1 2333/4885CA2 2351/4885PDPK1 2130/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 CA1 2980/4885CA2 3016/4885PDPK1 3532/4885

“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.