SCHEMBL1635758

SCHEMBL1635758

C[C@@H]1C[C@H]1C(=O)Nc1snc(-c2ccc3nn(C)cc3c2)c1Br

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 20/20 0.71
GRM1 Q13255 20/20 0.71
HTR2B P41595 2/20 0.67

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
SCHEMBL906582 0.88 GRM5 (0.65) GRM5GRM1HTR2B
SCHEMBL1637883 0.88 GRM5 (0.57) GRM5GRM1HTR2B
SCHEMBL8005692 0.83 GRM5 (1.00) GRM5GRM1HTR2B
Hydrochloric Acid SCHEMBL1637429 0.82 GRM5 (1.00) GRM5GRM1HTR2B
Hydrochloric Acid SCHEMBL2486027 0.82 GRM5 (1.00) GRM5GRM1HTR2B
Hydrochloric Acid SCHEMBL2482885 0.80 GRM5 (1.00) GRM5GRM1HTR2B
Hydrochloric Acid SCHEMBL2484386 0.80 GRM5 (1.00) GRM5GRM1HTR2B
SCHEMBL1636413 0.80 GRM5 (1.00) GRM5GRM1HTR2B
SCHEMBL2484580 0.80 GRM5 (1.00) GRM5GRM1HTR2B
SCHEMBL1635768 0.80 GRM5 (1.00) GRM5GRM1HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276759-B1 3-INDAZOLYL-4-PYRIDYLISOTHIAZOLES LILLY CO ELI (US) 2011-10-19 EP disclosed
US-7932274-B2 3-indazolyl-4-pyridylisothiazoles ELI LILLY AND COMPANY (US) 2011-04-26 US disclosed