SCHEMBL22652172

SCHEMBL22652172

c1ccc(-c2cccc(-c3nc(-n4c5ccc6ccccc6c5c5ccc6ccccc6c54)nc4sc5ccccc5c34)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ NPY1R P25929 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NPY2R P49146 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL23983710 0.95 — —
SCHEMBL22652454 0.93 ELANE (0.31) —
SCHEMBL22652359 0.93 ELANE (0.32) CYP1A1CYP1B1LMNAMAPT
SCHEMBL22652179 0.90 ELANE (0.30) —
SCHEMBL23983779 0.88 ELANE (0.30) —
SCHEMBL23983776 0.88 ELANE (0.31) —
SCHEMBL22652184 0.87 KDM4E (0.32) ALDH1A1MAPTHPGD
SCHEMBL22652310 0.87 ADK (0.31) —
SCHEMBL22652189 0.87 — —
SCHEMBL22652182 0.86 ADK (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200358004-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME, AND AN ELECTROLUMINESCENT DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2020-11-12 — — 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 (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-20200358004-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME, AND AN ELECTROLUMINESCENT DEVICE THEREOF LEF1, PIEZO1, OR10J3 CYP1A1 1712/4885CYP1B1 2850/4885NPC1 2262/4885

“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.

Send feedback