SCHEMBL6370517

SCHEMBL6370517

Cc1cc(N2CCOCC2)c2ccc(OCc3ccccc3)cc2n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 5/20 0.65
HSD17B10 Q99714 3/20 0.53
PRKDC P78527 4/20 0.52
NME2 P22392 1/20 0.49
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
PRMT5 O14744 1/20 0.46
METTL3 Q86U44 1/20 0.46
PARP14 Q460N5 1/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL5033351 0.90 NCF1 (0.61) NCF1HSD17B10ADRB2ADRB1MAPT
SCHEMBL5037448 0.89 NCF1 (0.63) NCF1HSD17B10ADRB2ADRB1KDM4E
Hydrochloric Acid SCHEMBL5040456 0.88 NCF1 (0.62) NCF1HSD17B10ADRB2ADRB1KDM4E
SCHEMBL5036322 0.87 PRKDC (0.55) NCF1HSD17B10PRKDCMETTL3KDM4E
Hydrochloric Acid SCHEMBL5035842 0.86 PRKDC (0.55) NCF1HSD17B10PRKDCMETTL3KDM4E
SCHEMBL5037488 0.83 NCF1 (0.48) NCF1HSD17B10PRKDCMETTL3KDM4E
Hydrochloric Acid SCHEMBL5035748 0.82 NCF1 (0.47) NCF1HSD17B10PRKDCMETTL3KDM4E
SCHEMBL5036125 0.81 NCF1 (0.45) NCF1ADRB2ADRB1MAPTALDH1A1
SCHEMBL5033338 0.81 NCF1 (0.45) NCF1ADRB2ADRB1MAPTALDH1A1
SCHEMBL5033346 0.81 NCF1 (0.45) NCF1ADRB2ADRB1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100376557-C Quinoline derivatives as ligands for neuropeptide Y receptors HOFFMANN LA ROCHE (CH) 2008-03-26 CN disclosed
US-20050049413-A1 Quinoline derivatives MUELLER WERNER (CH) 2005-03-03 US disclosed
US-6818767-B2 NEUROPEPTIDE Y (NPY) ANTAGONISTS FOR THE TREATMENT OR PREVENTION OF ARTHRITIS, CARDIOVASCULAR DISEASES, DIABETES, RENAL FAILURE, EATING DISORDERS, OR OBESITY HOFFMANN-LA ROCHE INC. 2004-11-16 US disclosed
CN-1522249-A Quinoline derivatives as ligands for neuropeptide Y receptors 2004-08-18 CN disclosed
US-20020198194-A1 Quinoline derivatives HOFFMANN-LA ROCHE INC. 2002-12-26 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 (2 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-20020198194-A1 Quinoline derivatives NPY2R, NPY1R, NPY4R NCF1 1052/4885HSD17B10 3906/4885PRKDC 4750/4885
US-20050049413-A1 Quinoline derivatives NPY2R, NPY1R, NPY4R NCF1 1052/4885HSD17B10 3906/4885PRKDC 4750/4885

“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.