SCHEMBL25758821

SCHEMBL25758821

CC(C)NC(=O)c1cc2c(F)ccc(F)c2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 0.50
TDO2 P48775 7/20 0.50
ALOX15 P16050 1/20 0.50
HRH4 Q9H3N8 2/20 0.49
NSD2 O96028 1/20 0.46
SETD2 Q9BYW2 1/20 0.46
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RCE1 Q9Y256 1/20 0.42
ALPL P05186 1/20 0.42
ALB P02768 1/20 0.41
IL2 P60568 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
FBP1 P09467 1/20 0.40
EIF4A3 P38919 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL24019764 0.90 ALOX15 (0.51) IDO1TDO2ALOX15HRH4NSD2
SCHEMBL24019767 0.89 KDM4E (0.52) IDO1TDO2ALOX15HRH4MEN1
SCHEMBL25758838 0.88 ALOX15 (0.46) IDO1TDO2ALOX15HRH4NSD2
SCHEMBL24019957 0.88 ALOX15 (0.52) IDO1TDO2ALOX15HRH4NSD2
SCHEMBL30471285 0.82 IDO1 (0.54) IDO1TDO2ALOX15HRH4NSD2
SCHEMBL24019700 0.81 ALB (0.55) ALOX15HRH4NSD2ALBIL2
SCHEMBL25758822 0.81 ALOX15 (0.57) ALOX15NSD2SETD2ALPLALB
SCHEMBL24019693 0.81 ALB (0.60) ALOX15HRH4MEN1KMT2ARCE1
SCHEMBL25758815 0.79 ALOX15 (0.58) ALOX15HRH4MEN1KMT2ARCE1
SCHEMBL24740347 0.79 ALOX15 (0.61) ALOX15HRH4MEN1KMT2AALPL

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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US disclosed
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 IDO1 1859/4885TDO2 1845/4885ALOX15 1455/4885

“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.