SCHEMBL21882370

SCHEMBL21882370

O=C(NN1CCNCC1)c1cc2cc(Cl)ccc2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
ATF4 P18848 9/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
HRH4 Q9H3N8 1/20 0.51
BCAT1 P54687 1/20 0.50
ADAMTS4 O75173 1/20 0.46
ADAMTS5 Q9UNA0 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46

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
Trifluoroacetic Acid SCHEMBL21819430 0.92 ATF4 (0.50) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL21882069 0.84 ATF4 (0.57) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL27865005 0.83 RAB9A (0.52) L3MBTL1NPC1RAB9ABCAT1KDM4E
Hydrochloric Acid SCHEMBL27726072 0.82 RAB9A (0.51) L3MBTL1NPC1RAB9ABCAT1KDM4E
SCHEMBL24998177 0.82 ATF4 (0.55) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL29988250 0.82 ATF4 (0.55) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL30578702 0.81 ATF4 (0.57) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL23920291 0.81 ATF4 (0.57) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL21819462 0.80 ATF4 (0.63) L3MBTL1ATF4NPC1RAB9AHRH4
SCHEMBL22777693 0.80 ATF4 (0.56) L3MBTL1ATF4NPC1RAB9AHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11166942-B2 Inhibitors of integrated stress response pathway Praxis Biotech LLC (US) 2021-11-09 US disclosed
US-20200101047-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY Praxis Biotech LLC 2020-04-02 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-11166942-B2 Inhibitors of integrated stress response pathway ATF4, DDIT3, ATF1 L3MBTL1 1975/4885ATF4 1/4885NPC1 2384/4885
US-20200101047-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY ATF4, DDIT3, ATF1 L3MBTL1 1975/4885ATF4 1/4885NPC1 2384/4885

“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.