SCHEMBL23341007

SCHEMBL23341007

CNCC(O)C(C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
TDP1 Q9NUW8 3/20 0.35
HIF1A Q16665 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP2C9 P11712 2/20 0.35
HTR1A P08908 1/20 0.35
THPO P40225 1/20 0.35
BLM P54132 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NMUR2 Q9GZQ4 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
ADRB1 P08588 2/20 0.33
ADRA2A P08913 2/20 0.33
ADRB3 P13945 2/20 0.33
ADRA2B P18089 2/20 0.33
ADRA2C P18825 2/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
ADRB2 P07550 2/20 0.32
CYP3A4 P08684 2/20 0.32

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
SCHEMBL12967296 0.78
SCHEMBL4790074 0.74
SCHEMBL24787937 0.72 KISS1R (0.35) KDM4ETDP1HIF1AALDH1A1CYP2C9
SCHEMBL256762 0.70
SCHEMBL25588699 0.70
SCHEMBL18502866 0.70
SCHEMBL12797342 0.70
SCHEMBL11248506 0.70
SCHEMBL20281283 0.70 KDM4E (0.33) KDM4ETDP1HIF1AALDH1A1CYP2C9
SCHEMBL15873657 0.69 TSHR (0.58) TSHR

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-11667613-B2 Antiviral pyrazolopyridinone compounds NOVARTIS AG (CH) 2023-06-06 US disclosed
US-20210130302-A1 Antiviral Pyrazolopyridinone Compounds NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC 2021-05-06 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 (2 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-11667613-B2 Antiviral pyrazolopyridinone compounds ZC3HAV1, TYMP, ZC3HAV1L KDM4E 139/4885TDP1 270/4885HIF1A 1980/4885
US-20210130302-A1 Antiviral Pyrazolopyridinone Compounds ZC3HAV1, TYMP, ZC3HAV1L KDM4E 139/4885TDP1 270/4885HIF1A 1980/4885

“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.