SCHEMBL31428673

SCHEMBL31428673

CC(=O)N(Cc1ccc2nc(C)ccc2c1)C1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.51
SLC6A4 P31645 4/20 0.51
SLC6A3 Q01959 3/20 0.51
KCNH2 Q12809 3/20 0.47
PIK3CD O00329 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.37
KLKB1 P03952 2/20 0.36
KDM2B Q8NHM5 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL24975620 1.00 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3KCNH2PIK3CD
SCHEMBL31428457 0.86 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3KCNH2PIK3CD
SCHEMBL30163473 0.85 NR1H4 (0.38) SLC6A2SLC6A4SLC6A3KCNH2HCAR2
SCHEMBL31429036 0.82 HRH3 (0.44) SLC6A2SLC6A4SLC6A3KCNH2HRH3
SCHEMBL31428916 0.80 KCNH2 (0.51) SLC6A2SLC6A4SLC6A3KCNH2HRH3
SCHEMBL24975787 0.77 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3KCNH2PIK3CD
SCHEMBL31429018 0.72 HTR2A (0.42) SLC6A2SLC6A4SLC6A3KCNH2HRH3
SCHEMBL31429023 0.70 KCNH2 (0.36) SLC6A2SLC6A4SLC6A3KCNH2HCAR2
SCHEMBL24977046 0.70 KCNH2 (0.36) SLC6A2SLC6A4SLC6A3KCNH2HCAR2
SCHEMBL31428702 0.69 NPC1 (0.39) SLC6A2SLC6A4SLC6A3HRH3NPC1

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 SLC6A2 4445/4885SLC6A4 4572/4885SLC6A3 3887/4885

“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.