SCHEMBL22079528

SCHEMBL22079528

O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.71
MEN1 O00255 6/20 0.71
CTDSP1 Q9GZU7 2/20 0.69
TRPV1 Q8NER1 4/20 0.60
POLB P06746 1/20 0.60
CASP3 P42574 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
KDM4E B2RXH2 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
RXFP1 Q9HBX9 1/20 0.55
BRAF P15056 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
SCHEMBL6260500 0.83 KMT2A (1.00) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6263371 0.81 KMT2A (0.77) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6264004 0.80 KMT2A (0.76) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL12635981 0.79 KMT2A (1.00) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6259571 0.79 KMT2A (0.74) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6263607 0.79 RXFP1 (0.75) KMT2AMEN1CTDSP1CASP3KDM4E
SCHEMBL12635988 0.79 KMT2A (1.00) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6264128 0.78 CASP3 (0.86) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL6260508 0.77 KDM4E (0.68) KMT2AMEN1CTDSP1POLBCASP3
SCHEMBL2914329 0.76 TRPV1 (0.74) KMT2AMEN1TRPV1NPC1RAB9A

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-20220031661-A1 SMALL MOLECULE INHIBITORS OF THE BFRB:BFD INTERACTION UNIVERSITY OF KANSAS 2022-02-03 US disclosed
WO-2020117832-A1 SMALL MOLECULE INHIBITORS OF THE BFRB:BFD INTERACTION UNIVERSITY OF KANSAS (US) 2020-06-11 WO 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-20220031661-A1 SMALL MOLECULE INHIBITORS OF THE BFRB:BFD INTERACTION BLVRB, TFPI, ETFB KMT2A 3788/4885MEN1 4178/4885CTDSP1 2534/4885

“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.