SCHEMBL5775657

SCHEMBL5775657

CCOC(=O)c1[nH]c(-c2ccccc2)cc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.52
MAPT P10636 9/20 0.52
HPGD P15428 8/20 0.52
HSD17B10 Q99714 6/20 0.52
SMN1; SMN2 Q16637 6/20 0.52
RAB9A P51151 6/20 0.52
KDM4E B2RXH2 5/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
NPC1 O15118 4/20 0.52
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52
TUBA1B P68363 1/20 0.52
TUBA4A P68366 1/20 0.52
TUBB4B P68371 1/20 0.52
TUBB3 Q13509 1/20 0.52
TUBB2A Q13885 1/20 0.52
TUBB8 Q3ZCM7 1/20 0.52
TUBA3E Q6PEY2 1/20 0.52

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
SCHEMBL5773315 0.89 ALDH1A1 (0.50) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL2748256 0.87 LMNA (0.54) ALDH1A1MAPTHPGDSMN1; SMN2RAB9A
SCHEMBL5774019 0.86 MAPT (0.54) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL21264058 0.86 MAPT (0.54) ALDH1A1MAPTHPGDSMN1; SMN2RAB9A
SCHEMBL5771002 0.86 GCGR (0.55) ALDH1A1MAPTHPGDSMN1; SMN2RAB9A
SCHEMBL5772744 0.85 ALOX5 (0.50) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL28552623 0.85 TUBB4A (0.54) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL2748270 0.85 HPGD (0.56) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL3344995 0.84 TUBB4A (0.53) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL5773864 0.82 MAPT (0.50) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
US-11780838-B1 Pyrrolo[3,2-b]quinoline compounds as antibacterial agents King Faisal University (SA) 2023-10-10 US disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 CN disclosed
EP-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP disclosed
US-6583154-B1 Neuropeptide Y antagonist; pyrrolo-(3,2-b)pyridines and pyrrolo-(3,2-d)pyrimidines AMGEN INC. 2003-06-24 US disclosed
US-6187777-B1 PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES; NEUROPEPTIDE Y AND CORTICOTROPIN RELEASING FACTOR MODULATORS; DIETETICS; ANTIDIABETIC, ANTIINFLAMMATORY, AND ANTITUMOR AGENTS AMGEN INC. 2001-02-13 US disclosed
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP disclosed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 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-11780838-B1 Pyrrolo[3,2-b]quinoline compounds as antibacterial agents POLB, TOP2A, POLR2B ALDH1A1 3816/4885MAPT 3559/4885HPGD 972/4885

“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.