SCHEMBL10057991

SCHEMBL10057991

CCCCc1cc2cc3c(cc2s1)C(=O)c1cc2sc(CCCC)cc2cc1C3=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ ELANE P08246 1/20 0.32
▸ CTSG P08311 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ DAO P14920 1/20 0.31
▸ SLC37A4 O43826 1/20 0.31
▸ ALOX5 P09917 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
SCHEMBL2496088 0.77 PTGS2 (0.38) LMNAALDH1A1MAPT
SCHEMBL2469032 0.77 PTGS2 (0.38) LMNAALDH1A1MAPT
SCHEMBL13299960 0.77 PTGS2 (0.38) LMNAALDH1A1MAPT
SCHEMBL21166592 0.76 LMNA (0.34) LMNAMAPK1MEN1KMT2A
SCHEMBL20464571 0.76 LMNA (0.34) LMNAMAPK1
SCHEMBL19219814 0.75 LMNA (0.33) LMNAMAPK1MEN1ALDH1A1MAPT
SCHEMBL12265773 0.74 PTGS2 (0.36) ALDH1A1MAPT
SCHEMBL2367919 0.74 PTGS2 (0.36) ALDH1A1MAPT
SCHEMBL559602 0.74 PTGS2 (0.36) ALDH1A1MAPT
SCHEMBL18371551 0.73 LMNA (0.33) LMNAMAPK1ALDH1A1MAPT

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-20120012822-A1 AROMATIC COMPOUND AND METHOD FOR PRODUCING SAME KEIO UNIVERSITY (JP) 2012-01-19 — — US disclosed
US-20120012822-A1 AROMATIC COMPOUND AND METHOD FOR PRODUCING SAME KEIO UNIVERSITY (JP) 2012-01-19 — — 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-20120012822-A1 AROMATIC COMPOUND AND METHOD FOR PRODUCING SAME CCKBR, CCKAR, NPY2R LMNA 1047/4885MAPK1 2063/4885ELANE 4849/4885

“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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