SCHEMBL23531925

SCHEMBL23531925

O=C1Nc2ncc(Br)cc2CCC1N1CCOCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 1/20 0.34
CRBN Q96SW2 5/20 0.34
RECQL P46063 1/20 0.34
PIK3CD O00329 1/20 0.32
DDB1 Q16531 3/20 0.32
NR1I2 O75469 1/20 0.32
IDH1 O75874 1/20 0.32
IKZF3 Q9UKT9 1/20 0.32
AKR1B1 P15121 1/20 0.32
KMT2A Q03164 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
OPRK1 P41145 1/20 0.31
IMPDH2 P12268 1/20 0.31
FLT3 P36888 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL23532125 0.89 L3MBTL4 (0.36) ALDH1A1CRBNDDB1KMT2AOPRK1
SCHEMBL30160396 0.89 L3MBTL4 (0.36) ALDH1A1CRBNDDB1KMT2AOPRK1
SCHEMBL13800024 0.88 TRPV1 (0.35) ALDH1A1LMNATP53HTTTSHR
SCHEMBL30160267 0.87 SMYD3 (0.34) ALDH1A1CRBNDDB1FNTAFNTB
SCHEMBL23532161 0.87 SMYD3 (0.34) ALDH1A1CRBNDDB1FNTAFNTB
SCHEMBL23532122 0.86 CRBN (0.31) CRBNDDB1
SCHEMBL25704837 0.86 TSHR (0.38) ALDH1A1HTTTSHRCRBNPIK3CD
SCHEMBL23532172 0.85 CRBN (0.33) CRBNDDB1
SCHEMBL23532080 0.84 CRBN (0.32) CRBNDDB1AKR1B1
SCHEMBL25198512 0.83 FAAH (0.36) FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12473283-B2 Compounds and their use DEBIOPHARM INTERNATIONAL S.A. (CH) 2025-11-18 US disclosed
US-20230159519-A1 NOVEL COMPOUNDS AND THEIR USE DEBIOPHARM INTERNATIONAL S.A. (CH) 2023-05-25 US disclosed
US-20230159519-A1 NOVEL COMPOUNDS AND THEIR USE DEBIOPHARM INTERNATIONAL S.A. (CH) 2023-05-25 US disclosed
US-20230159519-A1 NOVEL COMPOUNDS AND THEIR USE DEBIOPHARM INTERNATIONAL S.A. (CH) 2023-05-25 US disclosed
EP-4077324-A1 NOVEL COMPOUNDS AND THEIR USE Debiopharm International SA (CH) 2022-10-26 EP disclosed
WO-2021123372-A1 NOVEL COMPOUNDS AND THEIR USE DEBIOPHARM INTERNATIONAL S.A. (CH) 2021-06-24 WO disclosed
WO-2021123372-A1 NOVEL COMPOUNDS AND THEIR USE DEBIOPHARM INTERNATIONAL S.A. (CH) 2021-06-24 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 (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-20230159519-A1 NOVEL COMPOUNDS AND THEIR USE LSS, PGLS, LDHB ALDH1A1 1885/4885LMNA 415/4885TP53 2062/4885
US-12473283-B2 Compounds and their use LSS, PGLS, LDHB ALDH1A1 1859/4885LMNA 281/4885TP53 1495/4885

“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.