SCHEMBL5087216

SCHEMBL5087216

CCCc1nc2c[n+]([O-])c3cc(OC4CCN(C(=O)OC(C)(C)C)CC4)ccc3c2s1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.44
CHEK2 O96017 1/20 0.43
PDE4D Q08499 3/20 0.41
PDE4A P27815 2/20 0.41
PDE4B Q07343 2/20 0.41
PDE4C Q08493 2/20 0.41
HRH3 Q9Y5N1 1/20 0.40
ALK Q9UM73 1/20 0.37
BRD4 O60885 1/20 0.37
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37

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
SCHEMBL5087087 0.84 GPR119 (0.43) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL5533769 0.82 HRH3 (0.33) CHEK2HRH3BRD4
SCHEMBL5090696 0.79 TLR8 (0.46) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL4237814 0.73 GPR119 (0.44) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL7477361 0.70 CHEK2 (0.49) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL2495984 0.70 GPR119 (0.58) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL5545225 0.70 TLR8 (0.46) GPR119
SCHEMBL23373231 0.68 GPR119 (0.63) GPR119CHEK2PDE4DPDE4APDE4B
SCHEMBL16456577 0.68 TLR8 (0.52)
SCHEMBL3645555 0.68 GPR119 (0.51) GPR119CHEK2PDE4DPDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180057509-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2018-03-01 US disclosed
US-20170088559-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2017-03-30 US disclosed
US-9546184-B2 Alkyloxy substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-01-17 US disclosed
US-20150266901-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2015-09-24 US disclosed
EP-1846419-B1 Alkoxy-substituted thiazoloquinolines and thiazolonaphthyridines 3M INNOVATIVE PROPERTIES CO (US) 2014-04-16 EP disclosed
US-20080318998-A1 Alkyloxy Substituted Thiazoloquinolines and Thiazolonaphthyridines COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-25 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-20150266901-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, IFNG, TSLP GPR119 1234/4885CHEK2 877/4885PDE4D 2640/4885
US-20170088559-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, IFNG, TSLP GPR119 1234/4885CHEK2 877/4885PDE4D 2640/4885
US-20080318998-A1 Alkyloxy Substituted Thiazoloquinolines and Thiazolonaphthyridines IL2, IFNG, TSLP GPR119 1234/4885CHEK2 877/4885PDE4D 2640/4885
US-20180057509-A1 ALKYLOXY SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, IFNG, TSLP GPR119 1234/4885CHEK2 877/4885PDE4D 2640/4885

“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.