SCHEMBL2363794

SCHEMBL2363794

C=CCOC(=O)c1cccnc1N

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.63
TSHR P16473 1/20 0.63
HSD17B10 Q99714 1/20 0.63
CYP3A4 P08684 1/20 0.63
KDM4E B2RXH2 1/20 0.52
NAPRT Q6XQN6 1/20 0.51
PRKCI P41743 2/20 0.47
SNCA P37840 1/20 0.43
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LIG1 P18858 1/20 0.39

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
SCHEMBL9185211 0.83 CYP3A4 (0.65) ALDH1A1TSHRHSD17B10CYP3A4KDM4E
SCHEMBL2358122 0.83 CYP3A4 (0.65) ALDH1A1TSHRHSD17B10CYP3A4KDM4E
SCHEMBL8423197 0.82 CYP3A4 (0.63) ALDH1A1TSHRHSD17B10CYP3A4KDM4E
SCHEMBL9471700 0.82 CYP3A4 (0.63) ALDH1A1TSHRHSD17B10CYP3A4POLB
SCHEMBL2358545 0.82 CYP3A4 (0.63) ALDH1A1TSHRHSD17B10CYP3A4SNCA
SCHEMBL9693524 0.82 CYP3A4 (0.63) ALDH1A1TSHRHSD17B10CYP3A4KDM4E
SCHEMBL9693536 0.81 CYP3A4 (0.61) ALDH1A1TSHRHSD17B10CYP3A4SNCA
SCHEMBL181049 0.80 ALDH1A1 (0.60) ALDH1A1TSHRHSD17B10KDM4ENAPRT
SCHEMBL11860480 0.79 CYP3A4 (0.59) ALDH1A1TSHRHSD17B10CYP3A4KDM4E
SCHEMBL8041829 0.79 CYP3A4 (0.73) ALDH1A1TSHRHSD17B10CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125807-B1 IMIDAZO[1,2-A]PYRROLO[3,2-C]PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIV LEUVEN KATH (BE) 2011-08-03 EP claimed
US-20100093781-A1 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIVERSITE D'AUVERGNE CLERMONT 1 (FR) 2010-04-15 US claimed
EP-2125807-A2 IMIDAZO[1,2-A]PYRROLO[3,2-C]PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS Katholieke Universiteit Leuven (BE) 2009-12-02 EP claimed
WO-2008070937-A2 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2008-06-19 WO claimed
US-8404707-B2 Imidazo [1, 2-a] pyrrolo [3, 2-c] pyridine compounds useful as pestivirus inhibitors UNIVERSITE D'AUVERGNE CLERMONT 1 (FR) 2013-03-26 US disclosed
EP-2125807-B1 IMIDAZO[1,2-A]PYRROLO[3,2-C]PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIV LEUVEN KATH (BE) 2011-08-03 EP disclosed
US-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-06-24 US disclosed
US-20100093781-A1 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIVERSITE D'AUVERGNE CLERMONT 1 (FR) 2010-04-15 US disclosed
EP-2125807-A2 IMIDAZO[1,2-A]PYRROLO[3,2-C]PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS Katholieke Universiteit Leuven (BE) 2009-12-02 EP disclosed
WO-2008070937-A2 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2008-06-19 WO disclosed
EP-1844768-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-10-17 EP disclosed
US-3993656-A BRONCHODILATOR, HYPOTENSIVES MERCK & CO., INC. (US) 1976-11-23 US disclosed
US-3993656-A BRONCHODILATOR, HYPOTENSIVES MERCK & CO., INC. (US) 1976-11-23 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-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR NR3C2, AGTR1, AGTR2 ALDH1A1 1053/4885TSHR 173/4885HSD17B10 665/4885
US-20100093781-A1 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS PPM1D, CDKN1A, PPM1A ALDH1A1 1442/4885TSHR 2748/4885HSD17B10 4067/4885

“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.