SCHEMBL25622902

SCHEMBL25622902

CCc1c(Br)nc(OC)nc1OC

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
CYP1A2 P05177 2/20 0.32
CRHR1 P34998 1/20 0.31
PGK1 P00558 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL25622904 0.80 PGK1 (0.31) TSHRPGK1
SCHEMBL23264142 0.78 TSHR (0.37) TSHRCYP1A2CYP2C19
SCHEMBL3638759 0.78 TLR8 (0.34) CYP1A2CRHR1
SCHEMBL501295 0.76 CYP1A2 (0.47) CYP1A2CRHR1
SCHEMBL23203443 0.74 LTA4H (0.40) TSHRCYP2C19
SCHEMBL23203437 0.74 TSHR (0.39) TSHRCYP1A2
SCHEMBL2725593 0.71 TSHR (0.42) TSHRCYP1A2
SCHEMBL14420862 0.67 TSHR (0.31) TSHRCYP1A2
SCHEMBL2673044 0.67 TSHR (0.39) TSHR
SCHEMBL1484587 0.66 MAPT (0.33) TSHRCRHR1

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-20230183186-A1 PYRIMIDINE CYCLOHEXENYL GLUCOCORTICOID RECEPTOR MODULATORS CORCEPT THERAPEUTICS INCORPORATED 2023-06-15 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-20230183186-A1 PYRIMIDINE CYCLOHEXENYL GLUCOCORTICOID RECEPTOR MODULATORS NR3C1, NR3C2, MC2R TSHR 216/4885CYP1A2 1295/4885CRHR1 7/4885

“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.