SCHEMBL21710591

SCHEMBL21710591

Cc1ccc(-c2ccccc2)cc1-c1ccc2c(c1)c1cccc3c4c5ccccc5ccc4n2c13

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.33
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
FLT3 P36888 1/20 0.32
TSPO P30536 1/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP1A2 P05177 3/20 0.32
MAPT P10636 2/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ACHE P22303 1/20 0.32
SLC6A2 P23975 1/20 0.32
AHR P35869 1/20 0.32
HPGD P15428 2/20 0.31
CYP2A6 P11509 1/20 0.31
TSHR P16473 1/20 0.31
NPC1 O15118 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
SCHEMBL22858105 0.89 PTGES (0.35) PTGESCA12CA1CA2CA9
SCHEMBL21718134 0.89 PTGES (0.35) PTGESCA12CA1CA2CA9
SCHEMBL22679281 0.89 PTGES (0.35) PTGESCA12CA1CA2CA9
SCHEMBL22858086 0.88 PTGES (0.35) PTGESCA12CA1CA2CA9
SCHEMBL22679611 0.87 KDM4E (0.34) CA12CA1CA2CA9FLT3
SCHEMBL21710650 0.87 TSPO (0.41) TSPOALDH1A1CYP1A2MAPTHPGD
SCHEMBL21718136 0.87 PTGES (0.34) PTGESCA12CA1CA2CA9
SCHEMBL21718104 0.86 KDM4E (0.35) PTGESCA12CA1CA2CA9
SCHEMBL15460123 0.86 TSPO (0.40) TSPOALDH1A1CYP1A2MAPTHPGD
SCHEMBL21710702 0.85 CA1 (0.37) CA1CA2ALDH1A1CYP1A2MAPT

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-20200052212-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 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 PTGES 2858/4885CA12 1890/4885CA1 2666/4885
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 PTGES 4031/4885CA12 961/4885CA1 2333/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 PTGES 4447/4885CA12 3033/4885CA1 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.