SCHEMBL20364889

SCHEMBL20364889

Cc1cc(O)c2c(c1)C(=O)C(Br)=CC2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 3/20 0.56
▸ ELANE P08246 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ CYP3A4 P08684 3/20 0.53
▸ MAPK1 P28482 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ TDP1 Q9NUW8 3/20 0.53
▸ ALOX15 P16050 3/20 0.53
▸ TSHR P16473 2/20 0.53
▸ TP53 P04637 2/20 0.53
▸ CYP1A1 P04798 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ BLM P54132 2/20 0.53
▸ CYP1B1 Q16678 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ PTP4A3 O75365 1/20 0.53
▸ GMNN O75496 1/20 0.53

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
SCHEMBL17183609 0.86 PIM1 (0.56) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL11919738 0.82 PIM1 (0.59) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL5809753 0.82 PIM1 (0.59) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL10402093 0.77 ELANE (0.56) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL12304029 0.75 ELANE (0.85) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL20364871 0.74 ELANE (0.59) PIM1ELANEALDH1A1MAPTMEN1
Ramentaceone SCHEMBL5904880 0.72 PIM1 (1.00) PIM1ELANEALDH1A1MAPTMEN1
Ramentaceone SCHEMBL30594728 0.72 PIM1 (1.00) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL20364866 0.71 PIM1 (0.59) PIM1ELANEALDH1A1MAPTMEN1
SCHEMBL11919739 0.71 PIM1 (0.59) PIM1ELANEALDH1A1MAPTMEN1

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-20180192648-A1 COMPOUNDS FOR INHIBITION OF FUNGAL MYCOTOXIN AND SPORULATION SOKOINE UNIVERSITY OF AGRICULTURE (TZ) 2018-07-12 — — 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-20180192648-A1 COMPOUNDS FOR INHIBITION OF FUNGAL MYCOTOXIN AND SPORULATION ERG28, CYP51A1, CDC20 PIM1 1671/4885ELANE 4108/4885ALDH1A1 3961/4885

“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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