SCHEMBL17830712

SCHEMBL17830712

O=C(CN1C(=O)C(=O)c2cc(F)ccc21)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 5/20 0.60
ALDH1A1 P00352 5/20 0.53
NSD2 O96028 1/20 0.51
TRPA1 O75762 1/20 0.49
CHRM5 P08912 2/20 0.47
KMT2A Q03164 1/20 0.47
ALDH3A1 P30838 2/20 0.47
CTRB1 P17538 1/20 0.46

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
SCHEMBL14876483 0.91 CTRB1 (0.49) PARK7ALDH1A1NSD2TRPA1KMT2A
SCHEMBL17830711 0.86 ALDH1A1 (0.63) PARK7ALDH1A1KMT2AALDH3A1CTRB1
SCHEMBL17830710 0.86 ALDH1A1 (0.64) PARK7ALDH1A1KMT2AALDH3A1CTRB1
SCHEMBL17830746 0.84 ALDH1A1 (0.51) PARK7ALDH1A1CHRM5ALDH3A1
SCHEMBL17830747 0.83 ALDH1A1 (0.52) PARK7ALDH1A1KMT2AALDH3A1
SCHEMBL14884742 0.79 PARK7 (0.65) PARK7ALDH1A1NSD2TRPA1CHRM5
SCHEMBL17830744 0.78 ALDH1A1 (0.55) ALDH1A1KMT2AALDH3A1
SCHEMBL578265 0.78 PARK7 (0.74) PARK7ALDH1A1NSD2TRPA1CHRM5
SCHEMBL17830745 0.78 ALDH1A1 (0.56) ALDH1A1KMT2AALDH3A1
SCHEMBL18954565 0.77 PARK7 (0.62) PARK7ALDH1A1NSD2CHRM5ALDH3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9943506-B2 BCL6 inhibitors as anticancer agents CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-9943506-B2 BCL6 inhibitors as anticancer agents CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS CORNELL UNIVERSITY 2016-06-16 US disclosed
US-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS CORNELL UNIVERSITY 2016-06-16 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-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS BCL6, BCL6B, BAZ2A PARK7 963/4885ALDH1A1 4832/4885NSD2 1343/4885

“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.