SCHEMBL22858080

SCHEMBL22858080

Cc1ccc(C#N)cc1-c1cc2c3ccccc3n3c4ccc5ccccc5c4c(c1)c23

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
ENPP3 O14638 1/20 0.36
PTGER4 P35408 1/20 0.36
MAPK1 P28482 1/20 0.35
ABL1 P00519 2/20 0.33
CYP3A4 P08684 3/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SRC P12931 1/20 0.32
PDPK1 O15530 1/20 0.31
LRRK2 Q5S007 1/20 0.31

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
SCHEMBL21717346 0.89 PTGER4 (0.37) CA1CA2ENPP3PTGER4CYP11B1
SCHEMBL21710702 0.88 CA1 (0.37) CA1CA2ENPP3PTGER4MAPK1
SCHEMBL21718133 0.87 PTGER4 (0.33) PTGER4MAPK1
SCHEMBL21710470 0.86 ENPP3 (0.40) CA1CA2ENPP3PTGER4MAPK1
SCHEMBL22858124 0.85 ENPP3 (0.38) CA1CA2ENPP3PTGER4MAPK1
SCHEMBL21710704 0.85 MAPK1 (0.36) CA1CA2ENPP3PTGER4MAPK1
SCHEMBL21710708 0.84 CA1 (0.40) CA1CA2ENPP3PTGER4MEN1
SCHEMBL22679281 0.84 PTGES (0.35) CA1CA2KDM4EALDH1A1CYP1A2
SCHEMBL21710482 0.83 PTGER4 (0.38) CA1CA2ENPP3PTGER4MAPK1
SCHEMBL22679280 0.83 CA1 (0.41) CA1CA2ENPP3PTGER4MAPK1

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 4 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-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

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-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 CA1 2333/4885CA2 2351/4885ENPP3 2238/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 CA1 2980/4885CA2 3016/4885ENPP3 3165/4885

“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.