SCHEMBL19397348

SCHEMBL19397348

c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cnc[nH]4)n3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.66
CYP11B2 P19099 3/20 0.66
CYP1A1 P04798 1/20 0.54
CYP1B1 Q16678 1/20 0.54
IDO1 P14902 5/20 0.50
CYP3A4 P08684 1/20 0.50
HPGDS O60760 1/20 0.47
LTA4H P09960 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP17A1 P05093 1/20 0.45
CYP19A1 P11511 1/20 0.45
CTRC Q99895 1/20 0.43
SIRT2 Q8IXJ6 3/20 0.41
NLN Q9BYT8 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL19397457 0.97 CYP11B1 (0.62) CYP11B1CYP11B2CYP1A1CYP1B1IDO1
SCHEMBL19397567 0.96 CYP11B1 (0.61) CYP11B1CYP11B2CYP1A1CYP1B1IDO1
SCHEMBL19397350 0.90 IDO1 (0.54) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397452 0.90 IDO1 (0.54) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397562 0.87 IDO1 (0.51) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397453 0.83 CYP3A4 (0.54) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397343 0.82 CYP11B1 (0.46) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397456 0.81 SCN9A (0.46) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL19397576 0.81 CYP3A4 (0.51) CYP11B1CYP11B2IDO1CYP3A4HPGDS
SCHEMBL2369049 0.80 CYP11B1 (1.00) CYP11B1CYP11B2IDO1CYP3A4HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10580995-B2 Compounds for organic electroluminescent components and organic electroluminescent devices using the same E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2020-03-03 US disclosed
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2017-09-28 US disclosed
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2017-09-28 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 (2 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-10580995-B2 Compounds for organic electroluminescent components and organic electroluminescent devices using the same C1S, AOC2, L1CAM CYP11B1 323/4885CYP11B2 389/4885CYP1A1 83/4885
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME L1CAM, C1S, F10 CYP11B1 799/4885CYP11B2 1013/4885CYP1A1 241/4885

“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.