SCHEMBL19976893

SCHEMBL19976893

CC(NC(=O)c1ccccc1)C(=O)Nc1ccccc1OC(F)F

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.60
HTT P42858 1/20 0.60
KMT2A Q03164 4/20 0.55
RAB9A P51151 3/20 0.55
MEN1 O00255 2/20 0.55
TSHR P16473 1/20 0.52
NPC1 O15118 2/20 0.51
ALOX12 P18054 1/20 0.49
HPGD P15428 1/20 0.46
CASP1 P29466 1/20 0.46
POLB P06746 1/20 0.43

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
SCHEMBL19976971 0.90 HDAC1 (0.53) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL19976980 0.85 NPC1 (0.66) HTTKMT2ARAB9AMEN1TSHR
SCHEMBL19976916 0.84 KMT2A (0.51) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL19977035 0.84 KMT2A (0.61) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL19976899 0.84 KMT2A (0.49) SMN1; SMN2KMT2ARAB9AMEN1NPC1
SCHEMBL19977046 0.83 KMT2A (0.50) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL19977006 0.82 APLNR (0.54) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL16999313 0.81 HTT (0.55) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL18261154 0.81 HTT (0.55) SMN1; SMN2HTTKMT2ARAB9AMEN1
SCHEMBL12780373 0.81 KMT2A (0.66) SMN1; SMN2HTTKMT2ARAB9AMEN1

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-20210198279-A1 ANTIBACTERIAL AGENTS: DUAL-TARGETED RNA POLYMERASE INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2021-07-01 US disclosed
US-9919998-B2 Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-03-20 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-20210198279-A1 ANTIBACTERIAL AGENTS: DUAL-TARGETED RNA POLYMERASE INHIBITORS POLM, POLR2E, POLR2H SMN1; SMN2 4390/4885HTT 4460/4885KMT2A 1708/4885

“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.