SCHEMBL25399338

SCHEMBL25399338

Cc1cccc(COCC=NO)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
GRM5 P41594 3/20 0.35
GRM1 Q13255 2/20 0.35
GABRA1 P14867 3/20 0.34
GABRG2 P18507 3/20 0.34
GABRB3 P28472 3/20 0.34
GABRA5 P31644 3/20 0.34
GABRA3 P34903 3/20 0.34
GABRA2 P47869 3/20 0.34
CCR1 P32246 1/20 0.34
CCR8 P51685 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DRD4 P21917 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HSD17B3 P37058 1/20 0.33
MBOAT4 Q96T53 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL25400377 0.81 KCNH2 (0.33) MBOAT4KCNH2KDM1AMAOAMAOB
SCHEMBL526379 0.80 CCR1 (0.39) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL526380 0.80 CCR1 (0.39) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL29099348 0.79 MEN1 (0.38) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL15477559 0.75 CCR1 (0.41) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL25400179 0.74 POLB (0.33)
SCHEMBL24034138 0.72 CHRNB2 (0.42) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL15984871 0.72 MEN1 (0.40) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL25399343 0.72 HSD17B3 (0.39) MEN1KMT2AOPRM1OPRD1GRM5
SCHEMBL2608859 0.71 ADORA2A (0.39) MEN1KMT2AOPRM1OPRD1GRM5

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 4 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
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 MEN1 800/4885KMT2A 2072/4885OPRM1 1410/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 MEN1 386/4885KMT2A 1197/4885OPRM1 4660/4885

“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.