SCHEMBL31428784

SCHEMBL31428784

O=Cc1cc(-c2cccnc2)c2cc(C(=O)N3CCOCC3)ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HPGD P15428 3/20 0.48
ERN1 O75460 2/20 0.46
PLAUR Q03405 1/20 0.45
GRM2 Q14416 1/20 0.45
AR P10275 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MGLL Q99685 1/20 0.44
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RIPK1 Q13546 1/20 0.44
GAA P10253 1/20 0.44
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44

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
SCHEMBL31428711 0.91 GRM2 (0.51) HPGDERN1PLAURGRM2ALDH1A1
SCHEMBL31429121 0.90 AR (0.56) MAPTMEN1KMT2AHPGDERN1
SCHEMBL31428712 0.89 GRM2 (0.49) HPGDERN1GRM2ARALDH1A1
SCHEMBL31428481 0.87 ERN1 (0.52) MEN1KMT2AHPGDERN1PLAUR
SCHEMBL31428671 0.86 HPGD (0.50) HPGDERN1PLAURGRM2ALDH1A1
SCHEMBL31429056 0.86 MAPT (0.54) MAPTMEN1KMT2AHPGDPLAUR
SCHEMBL31428987 0.86 RIPK1 (0.44) HPGDERN1GRM2ALDH1A1RIPK1
SCHEMBL24977240 0.85 HPGD (0.45) MAPTMEN1KMT2AHPGDERN1
SCHEMBL31428554 0.85 HPGD (0.44) MAPTHPGDERN1PLAURALDH1A1
SCHEMBL31428876 0.84 MKNK1 (0.53) HPGDERN1GRM2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 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 (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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS MAPT 4513/4885MEN1 1712/4885KMT2A 2837/4885

“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.