SCHEMBL31046326

SCHEMBL31046326

O=C(Nc1ccc(Cl)cc1)N1CCN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)CC1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.68
GAA P10253 2/20 0.68
MAPK1 P28482 1/20 0.68
PIK3CA P42336 2/20 0.66
MTOR P42345 2/20 0.66
PIK3CG P48736 2/20 0.66
MEN1 O00255 1/20 0.65
HTT P42858 1/20 0.65
KMT2A Q03164 1/20 0.65
TRPV1 Q8NER1 3/20 0.64
CA12 O43570 2/20 0.62
CA2 P00918 2/20 0.62
CA9 Q16790 2/20 0.62
SMN1; SMN2 Q16637 4/20 0.59
MAPT P10636 2/20 0.59
KDM4E B2RXH2 1/20 0.58
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54

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
SCHEMBL10594359 0.86 GAA (0.73) LMNAGAAMEN1KMT2ATRPV1
SCHEMBL13234944 0.82 CA12 (0.89) LMNAGAAMAPK1TRPV1CA12
SCHEMBL27979652 0.81 CA12 (0.71) LMNAGAAMAPK1MEN1KMT2A
SCHEMBL32189 0.80 MTOR (1.00) PIK3CAMTORPIK3CG
SCHEMBL32703 0.80 MTOR (0.74) PIK3CAMTORPIK3CG
SCHEMBL32482 0.78 MTOR (0.83) PIK3CAMTORPIK3CG
SCHEMBL13234938 0.78 CA12 (0.77) LMNAGAAMAPK1MEN1HTT
SCHEMBL32984 0.77 MTOR (0.77) PIK3CAMTORPIK3CG
SCHEMBL11290550 0.76 LMNA (0.57) LMNAGAAMAPK1MEN1KMT2A
SCHEMBL32635 0.76 PIK3CA (0.69) PIK3CAMTORPIK3CG

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-20260076973-A1 Compounds and methods for treating diseases caused by SARS-CoV-2 and other coronaviruses Viradem, Inc. (US) 2026-03-19 US disclosed
WO-2024151953-A1 COMPOUNDS AND METHODS FOR TREATING DISEASES CAUSED BY SARS-COV-2 AND OTHER CORONAVIRUSES VIRADEM INC. (US) 2024-07-18 WO 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-20260076973-A1 Compounds and methods for treating diseases caused by SARS-CoV-2 and other coronaviruses ACE2, ACE, SARS1 LMNA 1163/4885GAA 2875/4885MAPK1 2367/4885

“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.