SCHEMBL22612385

SCHEMBL22612385

O=C(COc1ccc(OC(F)(F)F)cc1)NC1CCC(N2CCN(c3ccc(C(F)F)cn3)C2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 3/20 0.49
▸ LMNA P02545 1/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MCHR1 Q99705 4/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ ATF4 P18848 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ IDH1 O75874 2/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ADIPOR2 Q86V24 1/20 0.38
▸ ADIPOR1 Q96A54 1/20 0.38

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
SCHEMBL22612387 1.00 LIPE (0.49) LIPELMNAKMT2AMCHR1KCNH2
SCHEMBL22612392 0.89 KMT2A (0.40) LIPELMNAKMT2AMCHR1ATF4
SCHEMBL22612391 0.89 KMT2A (0.40) LIPELMNAKMT2AMCHR1ATF4
SCHEMBL22612430 0.88 ATF4 (0.46) LMNAKMT2AMCHR1ATF4MEN1
SCHEMBL22612432 0.88 ATF4 (0.46) LMNAKMT2AMCHR1ATF4MEN1
SCHEMBL22622970 0.86 LIPE (0.42) LIPELMNAKMT2AMCHR1KCNH2
SCHEMBL22612446 0.85 ATF4 (0.56) LMNAATF4
SCHEMBL22612443 0.85 ATF4 (0.56) LMNAATF4
SCHEMBL22612449 0.85 NR3C1 (0.39) LIPE
SCHEMBL22612451 0.85 NR3C1 (0.39) LIPE

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
CN-112218851-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2021-01-12 — — CN disclosed
US-20200347033-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC 2020-11-05 — — US disclosed
US-20200347033-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC 2020-11-05 — — 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-20200347033-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, IRF3 LIPE 2628/4885LMNA 3558/4885KMT2A 4436/4885

“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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