SCHEMBL20484667

SCHEMBL20484667

CC(C)C(NC(=O)Nc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.61
CCR1 P32246 1/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
DGAT1 O75907 2/20 0.50
EPHX2 P34913 1/20 0.49
ACE P12821 5/20 0.48
ITGB3 P05106 1/20 0.48
ITGB1 P05556 1/20 0.48
ITGAV P06756 1/20 0.48
ITGA5 P08648 1/20 0.48
ITGA4 P13612 1/20 0.48
CMA1 P23946 1/20 0.47
THRB P10828 1/20 0.47
ALOX12 P18054 1/20 0.47
ACE2 Q9BYF1 3/20 0.47

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
SCHEMBL18586364 1.00 ELANE (0.61) ELANECCR1KMT2AMEN1DGAT1
SCHEMBL18586541 0.90 ELANE (0.60) ELANECCR1KMT2AMEN1DGAT1
SCHEMBL18619664 0.90 ELANE (0.60) ELANECCR1KMT2AMEN1EPHX2
SCHEMBL22209466 0.90 ELANE (0.60) ELANECCR1KMT2AMEN1EPHX2
SCHEMBL20484759 0.90 ELANE (0.60) ELANECCR1KMT2AMEN1DGAT1
SCHEMBL22209391 0.89 ALDH1A1 (0.54) ELANECCR1KMT2AMEN1CMA1
SCHEMBL22209390 0.89 ALDH1A1 (0.54) ELANECCR1KMT2AMEN1CMA1
SCHEMBL20484710 0.88 DGAT1 (0.54) ELANECCR1KMT2AMEN1DGAT1
SCHEMBL18621658 0.88 DGAT1 (0.54) ELANECCR1KMT2AMEN1DGAT1
SCHEMBL7309861 0.87 ELANE (0.62) ELANECCR1KMT2AMEN1DGAT1

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
EP-3341007-B1 MALT1 INHIBITORS AND USES THEREOF UNIV CORNELL (US) 2020-12-23 EP disclosed
US-20180251489-A1 MALT1 INHIBITORS AND USES THEREOF Cornell University Cornell Center for Technology Enterprise & Commercialization (CCTEC) (US) 2018-09-06 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-20180251489-A1 MALT1 INHIBITORS AND USES THEREOF MALT1, BCL3, BCL6 ELANE 2960/4885CCR1 1763/4885KMT2A 2424/4885

“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.