SCHEMBL2722243

SCHEMBL2722243

Nc1ccc(Br)nc1OC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
MAP2K3 P46734 1/20 0.31
ATR Q13535 1/20 0.30

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
SCHEMBL27905445 0.84 ALOX5 (0.36) KDM4EGLAPOLBMAPT
SCHEMBL2723798 0.81 HSD17B10 (0.33) KDM4EGLAPOLBMAPT
SCHEMBL2711904 0.78 CRHBP (0.32) KDM4EMAPT
SCHEMBL9939459 0.74 CYP3A4 (0.36)
SCHEMBL29948393 0.72 IDO1 (0.36) POLBMAPT
SCHEMBL156162 0.72 IDO1 (0.36) POLBMAPT
SCHEMBL17753601 0.72
SCHEMBL1711711 0.71 KDM4E (0.42) KDM4EGLAPOLBMAPTMAP2K3
SCHEMBL12374084 0.70 ADORA2A (0.44) KDM4EGLAMAPT
SCHEMBL18498761 0.70 GAA (0.33) MAPT

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-2632923-A1 QUINAZOLINE DERIVATIVES Merck Patent GmbH (DE) 2013-09-04 EP disclosed
WO-2012055466-A1 QUINAZOLINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-05-03 WO disclosed