SCHEMBL29954967

SCHEMBL29954967

Cc1cc(C#N)ccc1B(O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.48
CYP2A6 P11509 2/20 0.43
ALDH1A1 P00352 1/20 0.43
AR P10275 3/20 0.40
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA6 P23280 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CYP11B1 P15538 5/20 0.38
CYP11B2 P19099 5/20 0.38
MRGPRX4 Q96LA9 1/20 0.35
EGLN2 Q96KS0 2/20 0.35
FFAR1 O14842 1/20 0.35
MMP3 P08254 1/20 0.34

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
SCHEMBL1277292 1.00 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL22155013 0.85 AR (0.43) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL31555022 0.83 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL1822394 0.83 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL2527374 0.81 PARP15 (0.45) ENPP2CYP2A6ALDH1A1AR
SCHEMBL30461111 0.81 PARP15 (0.45) ENPP2CYP2A6ALDH1A1AR
SCHEMBL30461110 0.81 PARP15 (0.45) ENPP2CYP2A6ALDH1A1AR
SCHEMBL25211213 0.79 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL30537828 0.79 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12
SCHEMBL23191268 0.79 ENPP2 (0.48) ENPP2CYP2A6ALDH1A1ARCA12

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-20250326764-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS LLC (US) 2025-10-23 US disclosed
US-12312359-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2025-05-27 US disclosed
EP-4499612-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2025-02-05 EP disclosed
WO-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 WO disclosed
US-20230174541-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC 2023-06-08 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11479557-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2022-10-25 US 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 (4 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-20230174541-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 ENPP2 702/4885CYP2A6 4370/4885ALDH1A1 4369/4885
US-12312359-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 ENPP2 702/4885CYP2A6 4370/4885ALDH1A1 4369/4885
US-11479557-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 ENPP2 702/4885CYP2A6 4370/4885ALDH1A1 4369/4885
US-20250326764-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 ENPP2 702/4885CYP2A6 4370/4885ALDH1A1 4369/4885

“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.