SCHEMBL31428686

SCHEMBL31428686

O=Cc1cc(CN2CCOCC2)c2ccccc2n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MOK Q9UQ07 11/20 0.53
ERN1 O75460 1/20 0.50
GAA P10253 3/20 0.48
KDM4E B2RXH2 2/20 0.48
HPGD P15428 1/20 0.48
HIF1A Q16665 1/20 0.48
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL24976095 1.00 MOK (0.53) MOKERN1GAAKDM4EHPGD
SCHEMBL31428545 0.82 GRM2 (0.40) MOKGAAKDM4EHPGDALDH1A1
SCHEMBL24975640 0.82 GRM2 (0.40) MOKGAAKDM4EHPGDALDH1A1
SCHEMBL4731923 0.80 NCF1 (0.62) MOKGAAKDM4EHPGDHIF1A
SCHEMBL31428728 0.80 NCF1 (0.62) MOKGAAKDM4EHPGDHIF1A
SCHEMBL4735359 0.80 CYP2A13 (0.55) MOKGAAKDM4EHPGDHIF1A
SCHEMBL24975496 0.80 NCF1 (0.62) MOKGAAKDM4EHPGDHIF1A
SCHEMBL5093473 0.78 NCF1 (0.64) MOKGAAKDM4EHPGDALDH1A1
SCHEMBL31428429 0.77 ALDH1A1 (0.68) MOKGAAKDM4EHPGDALDH1A1
SCHEMBL31428850 0.74 MOK (0.49) MOKGAAKDM4EHIF1AALDH1A1

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 MOK 997/4885ERN1 1375/4885GAA 3675/4885

“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.