SCHEMBL25878282

SCHEMBL25878282

CC(C)(C)SOc1cc(CO)cc2cc(F)ccc12

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
NR3C1 P04150 3/20 0.32
EPAS1 Q99814 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NR3C2 P08235 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
SCHEMBL24123722 0.82 CYP4F2 (0.35) CYP4F2CYP4A11NR3C1EPAS1MEN1
SCHEMBL25878288 0.76 NR3C1 (0.34) NR3C1MEN1KMT2ANR3C2
SCHEMBL13131958 0.73 KDM4E (0.36) CYP4F2CYP4A11
SCHEMBL25877357 0.73 NR3C1 (0.31) NR3C1
SCHEMBL3517975 0.63 CYP1A2 (0.50) CYP4F2CYP4A11
SCHEMBL8499490 0.62 CYP1A2 (0.48) CYP4F2CYP4A11
SCHEMBL12711141 0.61 KDM4E (0.42)
SCHEMBL2172046 0.60 LIPE (0.41)
SCHEMBL16632605 0.60 CA2 (0.35) CYP4F2CYP4A11EPAS1MEN1KMT2A
SCHEMBL1458089 0.59 CYP4F2 (0.39) CYP4F2CYP4A11MEN1KMT2A

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-20230234965-A1 N-LINKED MACROCYCLIC 4-(PYRAZOL-5-YL)-INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-07-27 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-20230234965-A1 N-LINKED MACROCYCLIC 4-(PYRAZOL-5-YL)-INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BCL2L1, BAK1 CYP4F2 4662/4885CYP4A11 4505/4885NR3C1 2030/4885

“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.