SCHEMBL25319161

SCHEMBL25319161

Cc1cc(C(=O)N(C)C)c(Cl)nn1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.43
ALDH1A1 P00352 5/20 0.42
CNR1 P21554 1/20 0.40
PIK3C3 Q8NEB9 1/20 0.38
HPGD P15428 2/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
SPR P35270 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 3/20 0.33
POLB P06746 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GFER P55789 1/20 0.33
GAA P10253 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
SCHEMBL30508857 1.00 OPRK1 (0.43) OPRK1ALDH1A1CNR1PIK3C3HPGD
SCHEMBL3567012 0.83 ALDH1A1 (0.43) ALDH1A1CNR1PIK3C3HPGDHTT
SCHEMBL1713978 0.79 ALDH1A1 (0.46) ALDH1A1HPGDSMN1; SMN2MAPK1CASP1
SCHEMBL11910412 0.79 SMN1; SMN2 (0.43) ALDH1A1HPGDSMN1; SMN2MAPK1CASP1
SCHEMBL25319546 0.78 OPRK1 (0.43) OPRK1ALDH1A1PIK3C3HPGDMEN1
SCHEMBL30508796 0.78 OPRK1 (0.43) OPRK1ALDH1A1PIK3C3HPGDMEN1
SCHEMBL25300075 0.74 ALDH1A1 (0.43) OPRK1ALDH1A1HPGDKMT2AMAPT
SCHEMBL30501175 0.74 ALDH1A1 (0.43) OPRK1ALDH1A1HPGDKMT2AMAPT
SCHEMBL8828399 0.73 PIK3C3 (0.49) ALDH1A1CNR1PIK3C3HPGDHTT
SCHEMBL30508732 0.71 CASP1 (0.61) ALDH1A1MEN1KMT2AMAPTMAPK1

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
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
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 OPRK1 921/4885ALDH1A1 72/4885CNR1 206/4885

“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.