SCHEMBL7967579

SCHEMBL7967579

C=CCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
UNG P13051 4/20 0.58
TP53 P04637 1/20 0.52

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
SCHEMBL5309531 0.76 TP53 (0.63) TP53
SCHEMBL5298937 0.74 TP53 (0.71) TP53
SCHEMBL21221811 0.74 TP53 (0.61) TP53
SCHEMBL21234494 0.74 UNG (0.55) UNG
SCHEMBL4082607 0.74 MAPT (0.68) TP53
SCHEMBL1506784 0.73 UNG (1.00) UNG
SCHEMBL7950536 0.73 UNG (1.00) UNG
SCHEMBL7962222 0.73 UNG (1.00) UNG
SCHEMBL175889 0.73 ALDH1A1 (0.50) TP53
SCHEMBL6406231 0.73 ALDH1A1 (0.50) TP53

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
US-6177437-B1 VIRICIDES UNIVERSITY OF MASSACHUSETTS MEDICAL CENTER 2001-01-23 US disclosed