SCHEMBL5024367

SCHEMBL5024367

Cc1cc(N2CCCC2)c2ccc(Nc3cccnc3Cl)cc2n1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 5/20 0.50
BCL6 P41182 1/20 0.42
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PSMD14 O00487 1/20 0.40
APAF1 O14727 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL5026856 0.81 CDK1 (0.41) KDM4E
SCHEMBL5026867 0.81 CDK1 (0.41) KDM4E
SCHEMBL5024375 0.79 NCF1 (0.67) NCF1MAPTADRB2ADRB1GAA
SCHEMBL5025361 0.79 NCF1 (0.53) NCF1MAPTSMN1; SMN2ADRB2ADRB1
SCHEMBL27597817 0.76 NCF1 (0.52) NCF1MAPTSMN1; SMN2ADRB2ADRB1
SCHEMBL5035764 0.75 NCF1 (0.48) NCF1MAPTSMN1; SMN2ADRB2ADRB1
Hydrochloric Acid SCHEMBL5033328 0.74 NCF1 (0.47) NCF1MAPTSMN1; SMN2ADRB2ADRB1
SCHEMBL5026895 0.73 NCF1 (0.51) NCF1MAPTADRB2ADRB1GAA
SCHEMBL27700780 0.73 KDM4E (0.46) MAPTSMN1; SMN2GAAKDM4EKMT2A
SCHEMBL5024412 0.73 NCF1 (0.53) NCF1MAPTSMN1; SMN2ADRB2ADRB1

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
WO-2003066055-A1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 WO disclosed
US-20030153553-A1 Quinoline derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 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-20030153553-A1 Quinoline derivatives NPY1R, NPY4R, GLP1R NCF1 1858/4885BCL6 4398/4885MAPT 3523/4885

“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.