SCHEMBL21718080

SCHEMBL21718080

c1ccc2c(c1)ccc1c2c2cc(-c3cccc4c3oc3ccccc34)cc3c4ccccc4n1c32

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
PRKDC P78527 6/20 0.37
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
GGPS1 O95749 1/20 0.35
ATM Q13315 1/20 0.35
PTGES2 Q9H7Z7 1/20 0.35
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
AHR P35869 2/20 0.31
TP53 P04637 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
SCHEMBL22679270 0.89 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL21717852 0.88 ALOX5 (0.52) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL19541050 0.86 ALOX5 (0.50) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL21718042 0.85 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL20465293 0.85 ALOX5 (0.42) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL22858282 0.84 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL21710471 0.83 NPC1 (0.36) PRKDCTDP1L3MBTL1MEN1MAPT
SCHEMBL22679481 0.82 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL21710644 0.82 ALOX5 (0.56) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL16621657 0.82 ALOX5 (0.44) ALOX5PRKDCPIK3CDPIK3CBGGPS1

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 ALOX5 3128/4885PRKDC 4392/4885PIK3CD 3864/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 ALOX5 2868/4885PRKDC 4120/4885PIK3CD 3584/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 ALOX5 3266/4885PRKDC 1353/4885PIK3CD 4476/4885

“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.