SCHEMBL17570701

SCHEMBL17570701

NOc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4cccnc4)cc3)NC(=O)NC1=O)C2

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 20/20 0.84

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
SCHEMBL8227095 0.92 ADAM17 (1.00) ADAM17
SCHEMBL14466504 0.92 ADAM17 (0.84) ADAM17
SCHEMBL17570711 0.91 ADAM17 (0.84) ADAM17
SCHEMBL8423875 0.89 ADAM17 (0.81) ADAM17
SCHEMBL7905776 0.87 ADAM17 (1.00) ADAM17
SCHEMBL8226948 0.86 ADAM17 (0.75) ADAM17
SCHEMBL13436396 0.86 ADAM17 (0.78) ADAM17
SCHEMBL14466751 0.85 ADAM17 (0.84) ADAM17
SCHEMBL14466482 0.84 ADAM17 (0.63) ADAM17
SCHEMBL18699718 0.83 ADAM17 (0.70) ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1976849-B1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS MERCK SHARP & DOHME (US) 2016-03-09 EP disclosed