SCHEMBL7447435

SCHEMBL7447435

O=C(c1cccnc1)C1CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.58
ALDH1A1 P00352 2/20 0.57
APP P05067 1/20 0.57
GAA P10253 1/20 0.57
HCAR3 P49019 1/20 0.57
HCAR2 Q8TDS4 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.55
F7 P08709 1/20 0.55
F3 P13726 1/20 0.55
SARM1 Q6SZW1 1/20 0.55
SIRT2 Q8IXJ6 1/20 0.55
SIRT6 Q8N6T7 1/20 0.55
SIRT1 Q96EB6 1/20 0.55
SIRT3 Q9NTG7 1/20 0.55
SIRT5 Q9NXA8 1/20 0.55
SIRT4 Q9Y6E7 1/20 0.55
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL9665275 0.93 SLC18A3 (0.56) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL8245353 0.93 SLC18A3 (0.56) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL18239382 0.92 SLC18A3 (0.52) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL9668119 0.91 SLC18A3 (0.54) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL5046019 0.91 SLC18A3 (0.54) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL4670842 0.90 SLC18A3 (0.53) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL4670846 0.88 SLC18A3 (0.52) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL2427999 0.88 SLC18A3 (0.52) SLC18A3ALDH1A1APPGAAHCAR3
SCHEMBL15563729 0.88 SLC18A3 (0.52) SLC18A3ALDH1A1APPGAAHCAR3
Hydrochloric Acid SCHEMBL441400 0.87 MEN1 (0.54) SLC18A3ALDH1A1APPGAAHCAR3

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-1418909-B1 2-AMINO-4, 5-TRISUBSTITUTED THIAzOLYL DERIVATIVES AND THEIR USE AGAINST AUTOIMMUNE DISEASES JANSSEN PHARMACEUTICA NV (BE) 2013-02-20 EP disclosed
US-7803823-B2 2-amino-4,5-trisubstituted thiazolyl derivatives JANSSEN PHARMACEUTICA NV (BE) 2010-09-28 US disclosed
US-7803823-B2 2-amino-4,5-trisubstituted thiazolyl derivatives JANSSEN PHARMACEUTICA NV (BE) 2010-09-28 US disclosed
US-20070203189-A1 2-Amino-4,5-Trisubstituted Thiazolyl Derivatives LOVE CHRISTOPHER J 2007-08-30 US disclosed
US-20070203189-A1 2-Amino-4,5-Trisubstituted Thiazolyl Derivatives LOVE CHRISTOPHER J 2007-08-30 US disclosed
US-7232838-B2 2-amino-4,5-trisubstituted thiazolyl derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-19 US disclosed
US-7232838-B2 2-amino-4,5-trisubstituted thiazolyl derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-19 US disclosed
EP-1095025-A2 BENZIMIDAZOLES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM KG (DE) 2001-05-02 EP disclosed
WO-2000001704-A2 BENZIMIDAZOLES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-01-13 WO disclosed
US-5464847-A Moduators of corticotropin releasing factor ELF SANOFI (FR) 1995-11-07 US disclosed
EP-0442339-B1 3-Substituted pyridine methanols and fungicides containing them BASF AG (DE) 1994-06-15 EP disclosed
US-5174997-A Fungicides tolerated by plants BASF AKTIENGESELLSCHAFT (DE) 1992-12-29 US disclosed
EP-0442339-A2 3-Substituted pyridine methanols and fungicides containing them BASF Aktiengesellschaft (DE) 1991-08-21 EP 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-20070203189-A1 2-Amino-4,5-Trisubstituted Thiazolyl Derivatives IFNG, IL15, IL5 SLC18A3 4218/4885ALDH1A1 2097/4885APP 3145/4885

“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.