SCHEMBL7680992

SCHEMBL7680992

CCCCCNC(=O)[C@@H](N)Cc1ccc(O)c(I)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.49
TRPV1 Q8NER1 1/20 0.47
RRM1 P23921 1/20 0.46
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44
GNAI1 P63096 1/20 0.44
GRIA1 P42261 1/20 0.43

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
SCHEMBL7065286 0.88 DPP7 (0.49) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL17941640 0.81 GRIA1 (0.57) DPP7RRM1GRIA1
SCHEMBL17941639 0.81 GRIA1 (0.57) DPP7RRM1GRIA1
SCHEMBL20687046 0.81 GRIA1 (0.64) GRIA1
SCHEMBL8914296 0.78 DPP7 (0.55) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL25080948 0.78 CHRND (0.56) GRIA1
SCHEMBL987955 0.78 DPP7 (0.58) DPP7RRM1
SCHEMBL16994019 0.78 DPP7 (0.58) DPP7RRM1
SCHEMBL18194422 0.77 USP2 (0.54)
SCHEMBL8914559 0.77 NAAA (0.59) DPP7RRM1GNAI3GNAO1GNAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410585-B1 THERAPY FOR NON-INSULIN DEPEND DIABETES BIOVITRUM AB (SE) 2002-06-25 US disclosed
EP-1161421-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE Pharmacia & Upjohn Aktiebolag (SE) 2001-12-12 EP disclosed
WO-2000053583-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE BIOVITRUM AB (SE) 2000-09-14 WO disclosed