SCHEMBL5026876

SCHEMBL5026876

Cc1cc(N2CCCC2)c2ccc(NCc3ccc(C(F)(F)F)cc3)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HRH4 Q9H3N8 1/20 0.43
CTNNB1 P35222 4/20 0.43
TCF7L2 Q9NQB0 4/20 0.43
TERT O14746 1/20 0.42
CACNA1B Q00975 1/20 0.41

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
SCHEMBL5028710 0.99 NCF1 (0.48) NCF1MEN1KMT2AHRH4CTNNB1
SCHEMBL5024388 0.88 CTNNB1 (0.49) NCF1MEN1KMT2ACTNNB1TCF7L2
SCHEMBL5024554 0.88 NCF1 (0.51) NCF1MEN1KMT2ACTNNB1TCF7L2
SCHEMBL5028716 0.87 NCF1 (0.50) NCF1MEN1KMT2ACTNNB1TCF7L2
SCHEMBL5516708 0.87 NCF1 (0.46) NCF1MEN1KMT2A
SCHEMBL5026871 0.86 NPC1 (0.52) NCF1MEN1KMT2ACTNNB1TCF7L2
SCHEMBL5024595 0.84 RAB9A (0.54) NCF1MEN1KMT2A
SCHEMBL5022553 0.84 NCF1 (0.51) NCF1MEN1KMT2ACTNNB1TCF7L2
SCHEMBL5024451 0.83 NCF1 (0.46) NCF1MEN1KMT2AHRH4CACNA1B
SCHEMBL5026888 0.82 NCF1 (0.50) NCF1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474145-B1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2008-04-23 EP disclosed
CN-1627945-A Quinoline derivatives as NPY antagonists HOFFMANN LA ROCHE (CH) 2005-06-15 CN disclosed
EP-1474145-A1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-11-10 EP disclosed
US-6696467-B2 Quinoline derivatives HOFFMANN-LA ROCHE INC. 2004-02-24 US disclosed
US-20030153553-A1 Quinoline derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 US disclosed
WO-2003066055-A1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 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-20030153553-A1 Quinoline derivatives NPY1R, NPY4R, GLP1R NCF1 1858/4885MEN1 339/4885KMT2A 3673/4885

“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.