SCHEMBL21717366

SCHEMBL21717366

c1ccc(-c2cc3c4ccccc4n4c5cc6ccccc6cc5c(c2)c34)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
KDM4E B2RXH2 6/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 1/20 0.38
HTR6 P50406 2/20 0.37
NPY5R Q15761 2/20 0.35
TSPO P30536 1/20 0.35
KMT2A Q03164 5/20 0.34
MEN1 O00255 4/20 0.34
MAPT P10636 4/20 0.34
GAA P10253 2/20 0.34
NPC1 O15118 1/20 0.34
PABPC1 P11940 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
ATM Q13315 1/20 0.32
HTT P42858 2/20 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
SCHEMBL21717822 0.98 ESR1 (0.38) ESR1ESR2KDM4EHSD17B10TSHR
SCHEMBL21718047 0.98 ESR1 (0.38) ESR1ESR2KDM4EHSD17B10TSHR
SCHEMBL21718043 0.95 ESR1 (0.36) ESR1ESR2KDM4EHSD17B10TSHR
SCHEMBL19563804 0.93 ESR1 (0.40) ESR1ESR2KDM4EHSD17B10HTR6
SCHEMBL19563801 0.92 ESR1 (0.39) ESR1ESR2HSD17B10HTR6NPY5R
SCHEMBL19563781 0.92 ESR1 (0.39) ESR1ESR2KDM4EHSD17B10HTR6
SCHEMBL21718006 0.91 ESR1 (0.44) ESR1ESR2KDM4EHSD17B10TSHR
SCHEMBL21717862 0.89 ESR1 (0.36) ESR1ESR2KDM4EHSD17B10TSHR
SCHEMBL19563821 0.89 ESR1 (0.37) ESR1ESR2HTR6
SCHEMBL21710577 0.88 KDM4E (0.40) KDM4EHSD17B10TSHRHTR6TSPO

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-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 (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 ESR1 7/4885ESR2 3/4885KDM4E 2210/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 ESR1 6/4885ESR2 24/4885KDM4E 2086/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 ESR1 50/4885ESR2 119/4885KDM4E 2270/4885

“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.