SCHEMBL25768433

SCHEMBL25768433

CCNC(=O)c1cc2cc(F)cc(Cl)c2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.53
BRD4 O60885 4/20 0.42
METAP2 P50579 1/20 0.39
CNR1 P21554 1/20 0.39
HRH4 Q9H3N8 2/20 0.39
NUDT1 P36639 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL24740103 0.87 ALOX15 (0.58) ALOX15CNR1HRH4NUDT1
SCHEMBL25768556 0.83 MEN1 (0.47) ALOX15BRD4METAP2CNR1HRH4
SCHEMBL24740405 0.82 ALOX15 (0.50) ALOX15MEN1KMT2AHDAC3HDAC1
SCHEMBL24740100 0.81 ALOX15 (0.58) ALOX15HRH4NUDT1DRD2DRD3
SCHEMBL24019772 0.80 ALOX15 (0.53) ALOX15HRH4MEN1KMT2A
SCHEMBL25812181 0.79 HRH4 (0.43) HRH4MEN1KMT2A
SCHEMBL3106434 0.77 CDK1 (0.54) ALOX15HRH4MEN1KMT2A
SCHEMBL24740852 0.77 ALOX15 (0.60) ALOX15BRD4HRH4NUDT1DRD2
SCHEMBL3089645 0.77 HPGD (0.53) ALOX15HRH4MEN1KMT2A
SCHEMBL24740102 0.76 ALOX15 (0.63) ALOX15HRH4HDAC3HDAC1HDAC2

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 ALOX15 1455/4885BRD4 3186/4885METAP2 120/4885

“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.