SCHEMBL23938202

SCHEMBL23938202

Cc1cnn2c(CO)cccc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.35
CYP17A1 P05093 1/20 0.35
TLR8 Q9NR97 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
RHEB Q15382 1/20 0.31
ELANE P08246 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL23938203 0.84 CYP17A1 (0.33) CYP1A2CYP17A1TLR8TSHR
SCHEMBL24729953 0.79
SCHEMBL1290821 0.76 NR4A3 (0.42) TLR8TSHR
SCHEMBL21863437 0.75 DRD2 (0.41) CYP1A2CYP17A1TLR8MEN1KMT2A
SCHEMBL1290672 0.74 KDM4E (0.41) CYP1A2MEN1KMT2ACYP2C19TSHR
SCHEMBL25045802 0.72 DRD2 (0.40) CYP1A2CYP17A1TLR8
SCHEMBL24103795 0.72 TSHR (0.36) CYP1A2CYP17A1TLR8MEN1KMT2A
SCHEMBL21893906 0.69 PDE4B (0.33) CYP1A2CYP17A1TLR8MEN1KMT2A
SCHEMBL12145712 0.67 DRD4 (0.41) CYP1A2CYP17A1ELANETSHR
SCHEMBL9288787 0.66 POLB (0.43) CYP1A2MEN1KMT2ACYP2C19ELANE

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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors VALO HEALTH, INC. (US) 2022-12-13 US disclosed
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO EARLY DISCOVERY, INC. 2021-10-21 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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors USP28, USP25, USP24 CYP1A2 2136/4885CYP17A1 3468/4885TLR8 3437/4885
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS USP28, USP25, USP24 CYP1A2 2136/4885CYP17A1 3468/4885TLR8 3437/4885

“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.