SCHEMBL3882889

SCHEMBL3882889

NC(=S)c1ccc(-c2csnn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
KDM4E B2RXH2 1/20 0.55
RAB9A P51151 5/20 0.55
KMT2A Q03164 5/20 0.55
NPC1 O15118 4/20 0.55
POLB P06746 3/20 0.55
MEN1 O00255 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NOTUM Q6P988 1/20 0.55
CTSK P43235 1/20 0.47
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PKM P14618 2/20 0.44
LMNA P02545 1/20 0.44
MDM2 Q00987 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL1028065 0.82 MAPT (0.62) MAPTKDM4ERAB9AKMT2ANPC1
Hydrochloric Acid SCHEMBL5008268 0.81 MAPT (0.61) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL19900671 0.80 KMT2A (0.78) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL16697507 0.79 MAPT (0.63) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL16697505 0.79 MAPT (0.63) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL399793 0.76 RAB9A (0.61) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL1021624 0.75 MAPT (0.55) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL3502303 0.75 MAPT (0.62) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL118567 0.75 KMT2A (0.64) MAPTKDM4ERAB9AKMT2ANPC1
SCHEMBL1673852 0.75 KMT2A (0.64) MAPTKDM4ERAB9AKMT2ANPC1

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-1858900-B1 FUSED THIAZOLE DERIVATIVES HAVING AFFINITY FOR THE HISTAMINE H3 RECEPTOR GLAXO GROUP LTD (GB) 2009-01-07 EP disclosed
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor GLAXO GROUP LIMITED 2008-07-03 US disclosed
EP-1858900-A1 FUSED THIAZOLE DERIVATIVES HAVING AFFINITY FOR THE HISTAMINE H3 RECEPTOR GLAXO GROUP LIMITED (GB) 2007-11-28 EP disclosed
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 US disclosed
WO-2006097691-A1 FUSED THIAZOLE DERIVATIVES HAVING AFFINITY FOR THE HISTAMINE H3 RECEPTOR GLAXO GROUP LIMITED (GB) 2006-09-21 WO disclosed
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
US-6822097-B1 THIAZOLE-SUBSTITUTED QUINOLINE DERIVATIVES; ANTICARCINOGENIC AGENTS, ANTISTROKE AGENTS; APOPTOSIS AND CELL PROLIFERATION TREATMENT; NERVOUS SYSTEM DISORDERS AMGEN, INC. 2004-11-23 US disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 WO disclosed
EP-1286988-A2 1-(H-1,2,4-TRIAZOL-1-YL)BUTAN-2-OL DERIVATIVES Basilea Pharmaceutica AG (CH) 2003-03-05 EP disclosed
US-20010047017-A1 Azole derivatives HOFFMANN-LA ROCHE, INC. 2001-11-29 US disclosed
US-6319933-B1 1-(1H-1,2,4-triazol-1-yl)butan-2-ol derivatives; fungicides BASILEA PHARMACEUTICA AG (CH) 2001-11-20 US disclosed
WO-2001079196-A2 1-(H-1,2,4-TRIAZOL-1-YL)BUTAN-2-OL DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2001-10-25 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 (3 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-20010047017-A1 Azole derivatives ERG28, CYP51A1, CYP3A5 MAPT 2247/4885KDM4E 1105/4885RAB9A 1880/4885
US-20070032518-A1 Compounds and methods of use BAX, BAD, CASP3 MAPT 1974/4885KDM4E 2614/4885RAB9A 2403/4885
US-20080161289-A1 Fused Thiazole Derivatives Having Affinity for the Histamine H3 Receptor HRH3, HRH4, HRH2 MAPT 196/4885KDM4E 2424/4885RAB9A 2125/4885

“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.