SCHEMBL31428541

SCHEMBL31428541

O=Cc1ccc2cc(C(=O)N3CCC(N4CCOCC4)CC3)ccc2n1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 6/20 0.57
L3MBTL1 Q9Y468 5/20 0.57
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
SCN9A Q15858 4/20 0.50
EPHX2 P34913 2/20 0.47
ACACB O00763 1/20 0.47
ACACA Q13085 1/20 0.47
SCN10A Q9Y5Y9 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TP53BP1 Q12888 2/20 0.45
MBTD1 Q05BQ5 1/20 0.45
L3MBTL4 Q8NA19 1/20 0.45
CCR3 P51677 1/20 0.45
HRH3 Q9Y5N1 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
SCHEMBL31428758 0.89 PKM (0.50)
SCHEMBL31428578 0.85 L3MBTL3 (0.59) L3MBTL3L3MBTL1KDM4EALDH1A1SCN9A
SCHEMBL31428499 0.85 L3MBTL3 (0.45) L3MBTL3L3MBTL1ACACBACACAHRH3
SCHEMBL31428833 0.81 CCR3 (0.66) L3MBTL3L3MBTL1KDM4EALDH1A1CCR3
SCHEMBL31428648 0.81 PKM (0.51) ALDH1A1KMT2A
SCHEMBL24975816 0.78 HPGD (0.49)
SCHEMBL31428621 0.78 HPGD (0.49)
SCHEMBL30163475 0.78 L3MBTL3 (0.42) L3MBTL3L3MBTL1KDM4EALDH1A1SCN9A
SCHEMBL31428689 0.76 SCN9A (0.44) L3MBTL3L3MBTL1ALDH1A1SCN9AMEN1
SCHEMBL31428690 0.76 SCN9A (0.44) L3MBTL3L3MBTL1ALDH1A1SCN9AMEN1

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 L3MBTL3 2092/4885L3MBTL1 1560/4885KDM4E 2663/4885

“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.