SCHEMBL969616

SCHEMBL969616

Brc1ccc(-c2cn3ccsc3n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.66
RAB9A P51151 11/20 0.66
SMN1; SMN2 Q16637 8/20 0.66
MAPT P10636 7/20 0.66
NFKB1 P19838 3/20 0.66
NFKB2 Q00653 3/20 0.66
RELA Q04206 3/20 0.66
TP53 P04637 11/20 0.59
LMNA P02545 2/20 0.56
HPGD P15428 5/20 0.56
ALDH1A1 P00352 2/20 0.56
HSD17B10 Q99714 2/20 0.56
ALOX15 P16050 1/20 0.56
ALOX12 P18054 1/20 0.56
TSHR P16473 2/20 0.56
RXFP1 Q9HBX9 1/20 0.56
POLB P06746 2/20 0.54
HTT P42858 2/20 0.52
PKM P14618 1/20 0.52
NPSR1 Q6W5P4 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
SCHEMBL5773733 0.83 TP53 (0.68) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL12692485 0.83 SMN1; SMN2 (0.70) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL12970198 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL4147815 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL1728599 0.83 SMN1; SMN2 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL1692138 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL30059210 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL2496897 0.83 TP53 (0.68) NPC1RAB9ASMN1; SMN2MAPTNFKB1
Bromide SCHEMBL3869607 0.82 SMN1; SMN2 (0.68) NPC1RAB9ASMN1; SMN2MAPTNFKB1
SCHEMBL12692390 0.81 TP53 (0.70) NPC1RAB9ASMN1; SMN2MAPTNFKB1

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
US-20150239905-A1 IMIDAZOPYRIDINE COMPOUNDS BIOVITRUM AB (PUBL) (SE) 2015-08-27 US disclosed
US-20140206662-A1 Imidazopyridine Compounds PROXIMAGEN LTD. (GB) 2014-07-24 US disclosed
EP-2376490-B1 IMIDAZOPYRIDINE COMPOUNDS PROXIMAGEN LTD (GB) 2013-01-23 EP disclosed
US-20120010188-A1 Imidazopyridine Compounds PROMIMAGEN LTD. (GB) 2012-01-12 US disclosed
EP-2376490-A1 IMIDAZOPYRIDINE COMPOUNDS Proximagen Limited (GB) 2011-10-19 EP disclosed
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US disclosed
WO-2010064020-A1 IMIDAZOPYRIDINE COMPOUNDS PROXIMAGEN LTD. (GB) 2010-06-10 WO disclosed
US-20090156512-A1 potent activity against resistant pneumococci MEIJI SEIKA KAISHA, LTD. (JP) 2009-06-18 US disclosed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP disclosed
WO-2007039146-A1 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-12 WO disclosed
US-4224334-A Antiinflammatory imidazothiazoles and thiazolopyrimidines DIAMOND SHAMROCK CORPORATION (US) 1980-09-23 US disclosed
US-4103016-A Antiinflammatory imidazothiazoles and thiazolopyrimidines DIAMOND SHAMROCK CORPORATION (US) 1978-07-25 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 (4 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-20120010188-A1 Imidazopyridine Compounds SSB, MIF, IDO1 NPC1 1153/4885RAB9A 3798/4885SMN1; SMN2 1109/4885
US-20150239905-A1 IMIDAZOPYRIDINE COMPOUNDS SSB, MIF, IDO1 NPC1 1153/4885RAB9A 3798/4885SMN1; SMN2 1109/4885
US-20090156512-A1 potent activity against resistant pneumococci H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAT1, NPM1 NPC1 50/4885RAB9A 377/4885SMN1; SMN2 1856/4885
US-20140206662-A1 Imidazopyridine Compounds SSB, NFKBIA, TPMT NPC1 2286/4885RAB9A 3886/4885SMN1; SMN2 887/4885

“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.