SCHEMBL19786553

SCHEMBL19786553

c1cnc(-n2c3ccccc3c3c4c5ccc6ccccc6c5sc4c4ccccc4c32)nc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
ACHE P22303 1/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
APEX1 P27695 1/20 0.30
MAPK1 P28482 1/20 0.30
PMP22 Q01453 1/20 0.30

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
SCHEMBL15126936 0.90 CYP3A4 (0.32) CYP3A4CYP1A1CYP1B1LMNAMAPT
SCHEMBL15126496 0.85 PRNP (0.33) CYP3A4CYP1A1CYP1B1ACHELMNA
SCHEMBL19786315 0.84 CYP1A1 (0.37) CYP1A1CYP1B1LMNAMAPT
SCHEMBL19786320 0.84 KDM4E (0.35) CYP1A1CYP1B1
SCHEMBL19786535 0.83 ATM (0.41) CYP1A1CYP1B1
SCHEMBL19786310 0.81 ALDH1A1 (0.41) CYP1A1CYP1B1LMNAMAPTMAPK1
SCHEMBL15126582 0.80 GABRP (0.30)
SCHEMBL15126674 0.80 KDM4E (0.30) MAPT
SCHEMBL19786533 0.80 CYP1B1 (0.34) CYP1A1CYP1B1ACHE
SCHEMBL19786550 0.80 PMM2 (0.36) CYP1A1CYP1B1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-10-03 US disclosed
WO-2018012781-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-01-18 WO 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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, OR51E2, ORAI2 CYP3A4 2035/4885CYP1A1 3556/4885CYP1B1 4207/4885

“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.