SCHEMBL32681001

SCHEMBL32681001

CCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)c3nccnc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.38
▸ EGFR P00533 1/20 0.35
▸ MET P08581 1/20 0.35
▸ COMT P21964 1/20 0.35
▸ MAPKAPK2 P49137 1/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ MAPT P10636 2/20 0.33
▸ THRB P10828 1/20 0.33
▸ CTSV O60911 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ PDE10A Q9Y233 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ METAP2 P50579 1/20 0.32

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
SCHEMBL32680893 0.85 PARP1 (0.38) PARP1EGFRMETSMN1; SMN2MAPT
SCHEMBL32680872 0.84 PARP1 (0.35) PARP1EGFRMETSMN1; SMN2CTSV
SCHEMBL21213504 0.78 ALDH1A1 (0.34) COMTALDH1A1KDM4EMETAP2NPY5R
SCHEMBL21213133 0.78 ALDH1A1 (0.34) COMTALDH1A1KDM4EMETAP2NPY5R
SCHEMBL21213134 0.77 ALDH1A1 (0.35) MAPTALDH1A1KDM4EHPGDMETAP2
SCHEMBL21213153 0.76 HTR2B (0.39) —
SCHEMBL21213501 0.76 GSK3B (0.36) METAP2
SCHEMBL32680946 0.75 PTAFR (0.36) COMTSMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL21213135 0.75 HTR2B (0.38) MAPKAPK2KDM4EMETAP2
SCHEMBL22809252 0.75 KDM4E (0.48) PARP1EGFRMETSMN1; SMN2CTSV

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-20260062607-A1 TWO-DIMENSIONAL LATTICE CONFINED SINGLE-MOLECULE-LIKE AGGREGATES PURDUE RESEARCH FOUNDATION (US) 2026-03-05 — — US claimed
US-20260062607-A1 TWO-DIMENSIONAL LATTICE CONFINED SINGLE-MOLECULE-LIKE AGGREGATES PURDUE RESEARCH FOUNDATION (US) 2026-03-05 — — 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-20260062607-A1 TWO-DIMENSIONAL LATTICE CONFINED SINGLE-MOLECULE-LIKE AGGREGATES BLM, MEF2D, SNCA PARP1 893/4885EGFR 3706/4885MET 3215/4885

“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.

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