SCHEMBL8881999

SCHEMBL8881999

CC(Cc1ccc(OCC(N)=O)cc1)N1CCOC(c2csc(C(F)(F)F)n2)C1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.35
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
DRD3 P35462 1/20 0.31
HTR2B P41595 1/20 0.31
GRIN1 Q05586 2/20 0.31
GRIN2B Q13224 2/20 0.31
CHRM3 P20309 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
GRM2 Q14416 2/20 0.30
CPT2 P23786 1/20 0.30
CPT1A P50416 1/20 0.30
P2RX7 Q99572 1/20 0.30

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
SCHEMBL8880142 0.93 PPARG (0.33) CHRM2HTR1ADRD3HTR2BGRIN1
SCHEMBL8880246 0.91 ALOX5AP (0.36) CHRM2HTR1ADRD3HTR2BGRIN1
SCHEMBL8878865 0.91 MEN1 (0.33) CPT2CPT1AP2RX7
SCHEMBL8880116 0.90 ADRB2 (0.36) GRIN1GRIN2BADRB2ADRB1ADRB3
Hydrochloric Acid SCHEMBL8880970 0.89 ADRB2 (0.35) GRIN1GRIN2BADRB2ADRB1ADRB3
SCHEMBL9251458 0.88 PIK3CA (0.38) PIK3CACHRM3HRH3ADRB2ADRB1
SCHEMBL8881673 0.88 ADRB1 (0.33) CHRM2HTR1ADRD3HTR2BGRIN1
SCHEMBL8880923 0.86 MEN1 (0.40) CHRM2HTR1ADRD3HTR2BCHRM3
SCHEMBL8880963 0.86 CHRM2 (0.32) CHRM2HTR1ADRD3HTR2BHRH3
SCHEMBL8880353 0.85 MEN1 (0.32) CHRM2HTR1ADRD3HTR2BHRH3

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-5604225-A DIETETICS; OBESITY DR. KARL THOMAE GMBH (DE) 1997-02-18 US disclosed
US-5457205-A Substituted thiazoles useful for treatment of diabetes DR. KARL THOMAE GMBH (DE) 1995-10-10 US disclosed
US-5219852-A Hypoglycemic agents, treatment of diabetes and obesity DR. KARL THOMAE GMBH (DE) 1993-06-15 US disclosed
EP-0239815-B1 SUBSTITUTED THIAZOLES AND OXAZOLES, MEDICINES CONTAINING THESE COMPOUNDS AND PROCESS FOR THEIR PREPARATION Dr. Karl Thomae GmbH (DE) 1991-07-24 EP disclosed
US-4886814-A LOWER BLOOD SUGAR DR. KARL THOMAS GMBH (DE) 1989-12-12 US disclosed
EP-0239815-A1 Substituted thiazoles and oxazoles, medicines containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1987-10-07 EP disclosed