SCHEMBL23920044

SCHEMBL23920044

CC(C)c1cc(C(C)C)c(C#N)c(=O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 15/20 0.39
ALDH1A1 P00352 10/20 0.39
HPGD P15428 7/20 0.39
GAA P10253 4/20 0.39
GLA P06280 4/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 2/20 0.37
DAO P14920 1/20 0.36
ATM Q13315 3/20 0.36
HIF1A Q16665 1/20 0.36
UPP1 Q16831 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34

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
SCHEMBL13277489 0.82 KDM4E (0.54) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL23920016 0.82 KDM4E (0.51) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL29332022 0.79 MEN1 (0.32) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL3592589 0.70 KDM4E (0.67) KDM4EALDH1A1HPGDGAAATM
SCHEMBL20350849 0.70 KDM4E (0.62) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL2819514 0.69 KDR (0.53) KDM4EATMKMT2A
SCHEMBL23183409 0.68 ALDH1A1 (0.41) KDM4EALDH1A1HPGDGAATP53
SCHEMBL2202173 0.68 BCL2L1 (0.54) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL28829325 0.68 KDM4E (0.38) KDM4EALDH1A1HPGDHSD17B10RECQL
SCHEMBL12180715 0.67 KDM4E (0.51) KDM4EALDH1A1HPGDGAAGLA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043621-B2 Small molecule inhibitors of Interleukin-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2024-07-23 US disclosed
US-12043621-B2 Small molecule inhibitors of Interleukin-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2024-07-23 US disclosed
US-20210317114-A1 SMALL MOLECULE INHIBITORS OF INTERLEUKIN-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2021-10-14 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-12043621-B2 Small molecule inhibitors of Interleukin-4 IL4, IL2, IL4I1 KDM4E 586/4885ALDH1A1 3144/4885HPGD 1770/4885
US-20210317114-A1 SMALL MOLECULE INHIBITORS OF INTERLEUKIN-4 IL4, IL2, IL4I1 KDM4E 586/4885ALDH1A1 3144/4885HPGD 1770/4885

“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.