SCHEMBL21710482

SCHEMBL21710482

Cc1ccc(C#N)cc1-c1ccc2c(c1)c1cc3ccccc3c3c4ccccc4n2c13

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.38
ENPP3 O14638 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
ABL1 P00519 2/20 0.33
MAPK1 P28482 1/20 0.33
PDPK1 O15530 1/20 0.31
LRRK2 Q5S007 1/20 0.31
BRD1 O95696 1/20 0.31
TAF1 P21675 1/20 0.31
BRPF1 P55201 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
FLT3 P36888 1/20 0.30
RORC P51449 2/20 0.30

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
SCHEMBL22858124 0.96 ENPP3 (0.38) PTGER4ENPP3CA1CA2CYP11B1
SCHEMBL22679283 0.86 PTGER4 (0.35) PTGER4ENPP3CA1CA2XDH
SCHEMBL21717404 0.85 ENPP3 (0.38) PTGER4ENPP3CA1CA2PDPK1
SCHEMBL21710700 0.85 CA1 (0.44) PTGER4ENPP3CA1CA2MAPK1
SCHEMBL21717870 0.85 ENPP3 (0.39) PTGER4ENPP3CA1CA2CYP11B1
SCHEMBL21710701 0.84 TSPO (0.34) KDM4EMAPTFLT3
SCHEMBL21717824 0.84 PTGER4 (0.41) PTGER4ENPP3CYP11B1CYP11B2ABL1
SCHEMBL21710702 0.84 CA1 (0.37) PTGER4ENPP3CA1CA2CYP11B1
SCHEMBL21710470 0.84 ENPP3 (0.40) PTGER4ENPP3CA1CA2CYP11B1
SCHEMBL21710663 0.83 ALDH1A3 (0.39) ENPP3CA1CA2XDHSLC22A12

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 5 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-20200365812-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-11-19 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 (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-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 PTGER4 4325/4885ENPP3 3165/4885CA1 2980/4885

“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.