SCHEMBL26884534

SCHEMBL26884534

CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc(-c5ccc(-c6ccccc6)cc5)c4)cc31)c1cc(C(C)(C)C)ccc1-2

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.35
▸ CA1 P00915 4/20 0.35
▸ CA2 P00918 4/20 0.35
▸ CA9 Q16790 4/20 0.35
▸ PPARG P37231 6/20 0.35
▸ PPARA Q07869 6/20 0.35
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PPARD Q03181 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.34
▸ PDK2 Q15119 3/20 0.33
▸ MCL1 Q07820 1/20 0.32
▸ ACMSD Q8TDX5 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ SLC6A9 P48067 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ SCD O00767 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
SCHEMBL24817303 0.97 CA12 (0.34) CA12CA1CA2CA9PPARG
SCHEMBL26884559 0.97 PPARG (0.36) CA12CA1CA2CA9PPARG
SCHEMBL25121731 0.97 PPARG (0.36) CA12CA1CA2CA9PPARG
SCHEMBL24817301 0.96 CA12 (0.33) CA12CA1CA2CA9PPARG
SCHEMBL23238785 0.94 MCL1 (0.33) CA12CA1CA2CA9PPARG
SCHEMBL23238784 0.94 MCL1 (0.34) CA12CA1CA2CA9PPARG
SCHEMBL23237383 0.93 MCL1 (0.34) CA12CA1CA2CA9PPARG
SCHEMBL23237381 0.92 MCL1 (0.34) CA12CA1CA2CA9PPARG
SCHEMBL23237004 0.92 MCL1 (0.35) CA12CA1CA2CA9PPARG
SCHEMBL23238752 0.91 MCL1 (0.34) CA12CA1CA2CA9PPARG

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-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 — — 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-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP2E1, GPX1, ERCC1 CA12 1771/4885CA1 2229/4885CA2 3751/4885

“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.

Send feedback