SCHEMBL5022762

SCHEMBL5022762

Cc1cc(N2CCCC2)c2ccc(NC(=O)c3cccnc3)cc2n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 8/20 0.64
▸ RAB9A P51151 8/20 0.64
▸ NPC1 O15118 7/20 0.64
▸ ALDH1A1 P00352 6/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ MAPT P10636 7/20 0.63
▸ LMNA P02545 2/20 0.63
▸ TP53 P04637 2/20 0.57
▸ GFER P55789 1/20 0.57
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ REV1 Q9UBZ9 1/20 0.52
▸ PIK3CA P42336 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ POLB P06746 1/20 0.51

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
SCHEMBL5022727 0.88 MAPT (0.49) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5025332 0.85 RAB9A (0.48) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5025333 0.85 RAB9A (0.48) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL27597762 0.84 HTR1A (0.57) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5022654 0.83 RAB9A (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5022650 0.83 RAB9A (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5022573 0.83 POLB (0.49) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5022565 0.83 POLB (0.49) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL5026960 0.82 MAPT (0.61) SMN1; SMN2RAB9ANPC1L3MBTL1MAPT
SCHEMBL5022732 0.81 RAB9A (0.45) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1

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 12 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 claimed
CN-1627945-A Quinoline derivatives as NPY antagonists HOFFMANN LA ROCHE (CH) 2005-06-15 — — CN claimed
EP-1474145-A1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-11-10 — — EP claimed
US-6696467-B2 Quinoline derivatives HOFFMANN-LA ROCHE INC. 2004-02-24 — — US claimed
US-20030153553-A1 Quinoline derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 — — US claimed
WO-2003066055-A1 QUINOLINE DERIVATIVES AS NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 — — WO claimed
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 SMN1; SMN2 2329/4885RAB9A 1050/4885NPC1 172/4885

“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.

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