SCHEMBL25782820

SCHEMBL25782820

CC(C)(C)NC(=O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.60
F3 P13726 1/20 0.60
PYGL P06737 5/20 0.60
HRH4 Q9H3N8 2/20 0.59
HRH3 Q9Y5N1 1/20 0.59
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
RXFP1 Q9HBX9 1/20 0.58
NHERF1 O14745 4/20 0.56
BCAT1 P54687 2/20 0.55
ALOX15 P16050 1/20 0.55
SMYD3 Q9H7B4 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
FLT3 P36888 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
SCHEMBL24740532 0.88 ALOX15 (0.71) F7F3PYGLHRH4HRH3
SCHEMBL17149709 0.84 NHERF1 (0.57) F7F3PYGLHRH4HRH3
SCHEMBL14845703 0.84 PIN1 (0.62) HRH4RXFP1ALOX15NPC1RAB9A
SCHEMBL12101200 0.83 ALOX15 (0.77) F7F3PYGLHRH4HRH3
SCHEMBL13334344 0.82 TP53 (0.47) PYGLHRH4MEN1KMT2ARXFP1
SCHEMBL19901352 0.82 HRH4 (0.51) PYGLHRH4HRH3KMT2ARXFP1
SCHEMBL12669766 0.80 KDM4E (0.64) NPC1RAB9AFLT3
SCHEMBL4933623 0.80 F7 (0.66) F7F3PYGLHRH4HRH3
SCHEMBL27464367 0.80 F7 (0.66) F7F3PYGLHRH4HRH3
SCHEMBL24198791 0.80 F7 (0.66) F7F3PYGLHRH4HRH3

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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV F7 1532/4885F3 553/4885PYGL 590/4885

“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.