SCHEMBL28523832

SCHEMBL28523832

NC(=O)OCCNc1ccccc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HDAC3 O15379 11/20 0.42
HDAC1 Q13547 11/20 0.42
HDAC2 Q92769 11/20 0.42
NCOR2 Q9Y618 6/20 0.42
HDAC10 Q969S8 6/20 0.42
HDAC6 Q9UBN7 6/20 0.42
HDAC4 P56524 5/20 0.42
HDAC7 Q8WUI4 5/20 0.42
HDAC11 Q96DB2 5/20 0.42
HDAC8 Q9BY41 5/20 0.42
HDAC9 Q9UKV0 5/20 0.42
HDAC5 Q9UQL6 5/20 0.42
PTGER4 P35408 3/20 0.42
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
GLA P06280 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL30316975 0.90 LMNA (0.49) LMNAHDAC3HDAC1HDAC2NCOR2
SCHEMBL7229502 0.85 KDM4E (0.45) HDAC3HDAC1HDAC2NCOR2HDAC10
SCHEMBL28678637 0.78 LMNA (0.36) LMNAHDAC3HDAC1PTGER4SMN1; SMN2
SCHEMBL28505377 0.78 PTGER4 (0.39) HDAC3HDAC1HDAC2NCOR2HDAC10
SCHEMBL15577833 0.77 LMNA (0.51) LMNAHDAC3HDAC1HDAC2NCOR2
SCHEMBL28538491 0.77 NPC1 (0.62) LMNASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL8720377 0.77 HDAC3 (0.41) LMNAHDAC3HDAC1HDAC2NCOR2
SCHEMBL28505378 0.76 HDAC3 (0.51) LMNAHDAC3HDAC1HDAC2NCOR2
SCHEMBL27972316 0.76 NCEH1 (0.43) LMNAPTGER4NPC1RAB9AALDH1A1
SCHEMBL6201094 0.75 MAPT (0.52) LMNAHDAC3HDAC1HDAC2NCOR2

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-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME GENEROS BIOPHARMA LTD. (CN) 2023-03-30 US disclosed
CN-111848598-A Heterocyclic ring-containing compound, application thereof and composition containing heterocyclic ring-containing compound 健艾仕生物医药有限公司 2020-10-30 CN 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-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME STAT5A, STAT5B, JAK2 LMNA 4482/4885HDAC3 43/4885HDAC1 60/4885

“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.