SCHEMBL25878288

SCHEMBL25878288

CC(C)(C)SOc1cc(C=O)cc2cc(F)ccc12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.34
NR3C2 P08235 2/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
PGR P06401 1/20 0.31
TSHR P16473 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
SCHEMBL25878282 0.76 CYP4F2 (0.33) NR3C1NR3C2MEN1KMT2A
SCHEMBL25877362 0.73 TTR (0.30)
SCHEMBL11811006 0.66 MEN1 (0.41) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL1818682 0.63 CYP2A6 (0.50) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL29953142 0.63 CYP2A6 (0.50) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL29956213 0.62 CYP2A6 (0.48) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL16632464 0.60 ALDH1A1 (0.38) MEN1KMT2AALDH1A1TSHR
SCHEMBL11594562 0.60 ALDH1A1 (0.57) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL31749884 0.59 KIF11 (0.33) ALDH1A1
SCHEMBL17310947 0.59 CYP1A2 (0.56) ALDH1A1TSHR

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 NR3C1 2030/4885NR3C2 3898/4885MEN1 1314/4885

“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.