SCHEMBL6447446

SCHEMBL6447446

Cc1c(C)c(N)c(N)c(C2CCc3ccccc32)c1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
PDPK1 O15530 1/20 0.40
ADRA1A P35348 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
CYP11B2 P19099 1/20 0.38
HTR6 P50406 3/20 0.38
CHRNA7 P36544 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
RET P07949 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL7584485 0.78 PIN1 (0.40) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL7584497 0.78 PDPK1 (0.42) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL10492489 0.77 ADRA1A (0.42) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL10492519 0.76 ADRA1A (0.38) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL10492671 0.75 IDO1 (0.40) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL2984209 0.71 IDO1 (0.48) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL8849605 0.71 DDB1 (0.53) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL78935 0.70 IDO1 (0.44) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL8735629 0.69 ADRA1A (0.46) IDO1PDPK1ADRA1ASIGMAR1CYP11B2
SCHEMBL2905254 0.69 ADRA1A (0.36) IDO1PDPK1ADRA1ASIGMAR1CYP11B2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050197425-A1 Thermosetting resin compositions, resin films and film articles TAMURA KAKEN CORPORATION (JP) 2005-09-08 US claimed
EP-4305681-A1 NEW CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS CREDOXYS GmbH (DE) 2024-01-17 EP disclosed
CN-116964026-A Novel cerium (IV) complexes and their use in electronics 克雷多西斯有限公司 2023-10-27 CN disclosed
US-20230092935-A1 CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS Credoxys GmbH (DE) 2023-03-23 US disclosed
WO-2022189431-A1 NEW CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS Credoxys GmbH (DE) 2022-09-15 WO disclosed
EP-4029069-A1 CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS Credoxys GmbH c/o Institut for Applied Physics (DE) 2022-07-20 EP disclosed
WO-2021048044-A1 CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS Technische Universität Dresden (DE) 2021-03-18 WO disclosed
EP-0467847-A1 Polyarylene ether with tetraphenylethylene units CIBA-GEIGY AG (CH) 1992-01-22 EP 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-20230092935-A1 CERIUM (IV) COMPLEXES AND THEIR USE IN ORGANIC ELECTRONICS CLIC4, KCNN4, CLN6 IDO1 1159/4885PDPK1 3519/4885ADRA1A 3705/4885

“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.