SCHEMBL22669514

SCHEMBL22669514

CC1(NC(=O)COc2ccc(Cl)c(Cl)c2)C=C(NC(=O)COCCc2ccc(Cl)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 5/20 0.41
▸ HTT P42858 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2B Q13224 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ADAMTS5 Q9UNA0 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL22669522 0.94 MAPT (0.39) GAAALDH1A1MEN1KMT2ANPC1
SCHEMBL22669139 0.93 HPGD (0.39) ATF4GAAALDH1A1MEN1KMT2A
SCHEMBL22669513 0.92 ATF4 (0.44) ATF4HTT
SCHEMBL22669234 0.91 ATF4 (0.42) ATF4GAAALDH1A1MEN1KMT2A
SCHEMBL22669484 0.90 HTT (0.40) HTTGAAALDH1A1GRIN1GRIN2B
SCHEMBL22669126 0.88 MAPK1 (0.39) HTTGAAMEN1KMT2ANPC1
SCHEMBL22669335 0.87 MAOA (0.36) ATF4GAAALDH1A1MEN1KMT2A
SCHEMBL22669227 0.87 ATF4 (0.44) ATF4GAAMEN1KMT2A
SCHEMBL22669232 0.86 ATF4 (0.43) ATF4GAAMEN1KMT2ANPC1
SCHEMBL22668971 0.86 ATM (0.36) GAAALDH1A1GRIN1GRIN2BADAMTS5

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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 — — 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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885HTT 2496/4885GAA 2139/4885

“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.

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