SCHEMBL25400596

SCHEMBL25400596

Cc1nc(C(=O)O)c(Cl)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
DAO P14920 4/20 0.39
HCAR2 Q8TDS4 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PIN1 Q13526 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NTRK1 P04629 1/20 0.32

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
SCHEMBL13451813 0.83 ALDH1A1 (0.37) ALDH1A1HPGDTSHRDAOHCAR2
SCHEMBL18412853 0.83 ALDH1A1 (0.35) ALDH1A1HPGDTSHRDAOSMN1; SMN2
SCHEMBL20866925 0.78 NPC1 (0.37) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL12228844 0.78 NPSR1 (0.50) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL8305364 0.77 ALDH1A1 (0.47) ALDH1A1HPGDTSHRDAOHCAR2
SCHEMBL2216614 0.77 SMN1; SMN2 (0.40) ALDH1A1HPGDTSHRDAOHCAR2
SCHEMBL16396526 0.76 ALDH1A1 (0.37) ALDH1A1HPGDTSHRDAOHCAR2
SCHEMBL4883695 0.76 ALDH1A1 (0.45) ALDH1A1HPGDTSHRHCAR2SMN1; SMN2
SCHEMBL10317272 0.75 ALDH1A1 (0.50) ALDH1A1HPGDTSHRSMN1; SMN2NPC1
SCHEMBL20440027 0.74 SMN1; SMN2 (0.38) ALDH1A1HPGDTSHRHCAR2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12570675-B2 Boronic acid compounds LG CHEM, LTD. (KR) 2026-03-10 US disclosed
US-20240101579-A1 BORONIC ACID COMPOUNDS LG CHEM, LTD. (KR) 2024-03-28 US disclosed
EP-4242213-A1 BORONIC ACID COMPOUND Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed
CN-116568310-A Boric acid compounds 株式会社LG化学 2023-08-08 CN disclosed
WO-2022123530-A1 BORONIC ACID COMPOUND 주식회사 엘지화학 2022-06-16 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-12570675-B2 Boronic acid compounds PSMB6, PSMB3, PSMB2 ALDH1A1 3621/4885HPGD 4573/4885TSHR 1670/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 ALDH1A1 2005/4885HPGD 4467/4885TSHR 4034/4885

“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.