SCHEMBL25945244

SCHEMBL25945244

Cc1cc(C#N)nn1-c1nc(Cl)ccc1CO

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
AR P10275 1/20 0.30

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
SCHEMBL31361250 0.84 KDM4E (0.31) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL31078137 0.81 RPS6KA5 (0.40) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL25318477 0.80 MEN1 (0.37) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL30508578 0.80 MEN1 (0.37) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL31361119 0.79 KDM4E (0.38) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL31416832 0.79 KDM4E (0.32) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL31361103 0.78
SCHEMBL25867032 0.77 MEN1 (0.36) MEN1CYP2C9CYP2C19KMT2AHSD17B10
SCHEMBL30986426 0.77 KDM4E (0.33) KDM4E
SCHEMBL31361289 0.77 GRM2 (0.40) KMT2AKDM4EAR

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
EP-4466258-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-11-27 EP disclosed
US-20240383875-A1 Benzimidazole Pyridine Derivatives HOFFMANN-LA ROCHE INC. (US) 2024-11-21 US disclosed
CN-118591534-A Novel benzimidazole pyridine derivatives 豪夫迈·罗氏有限公司 2024-09-03 CN disclosed
WO-2023139085-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-07-27 WO disclosed
WO-2023139085-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-07-27 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 (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-20240383875-A1 Benzimidazole Pyridine Derivatives H1-3, H1-2, H1-4 MEN1 1114/4885CYP2C9 120/4885CYP2C19 38/4885

“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.