SCHEMBL6918979

SCHEMBL6918979

NC(=O)OCc1ccc(-c2cnno2)cc1-c1cnno1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.32

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
SCHEMBL25419165 0.70 LRRK2 (0.32)
SCHEMBL18270917 0.68 NQO1 (0.35)
SCHEMBL28874743 0.60 KMT2A (0.51)
SCHEMBL9139255 0.60 TAAR1 (0.42)
SCHEMBL11317826 0.59 GRM5 (0.33) GRM5
SCHEMBL28634711 0.59 ACMSD (0.47)
SCHEMBL29501710 0.59 SMN1; SMN2 (0.48)
SCHEMBL27460313 0.59 MAPT (0.36)
SCHEMBL23093951 0.59 THRB (0.40)
SCHEMBL9123636 0.58 NQO1 (0.40)

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-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP disclosed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO disclosed