SCHEMBL3709588

SCHEMBL3709588

NC(=O)C(O)c1ccc2nc(Cc3ccc(Cl)c(Cl)c3)[nH]c(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEH1 O60930 1/20 0.53
PDE5A O76074 3/20 0.44
MAPT P10636 2/20 0.40
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40
TUBB8 Q3ZCM7 1/20 0.40
TUBA3E Q6PEY2 1/20 0.40
TUBA1A Q71U36 1/20 0.40
TUBA1C Q9BQE3 1/20 0.40
TUBB6 Q9BUF5 1/20 0.40
TUBB2B Q9BVA1 1/20 0.40
TUBB1 Q9H4B7 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 2/20 0.39

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
SCHEMBL403310 0.80 PDE5A (0.62) RNASEH1PDE5AMAPTTUBB4ATUBB
SCHEMBL3055325 0.75 MAPT (0.57) RNASEH1PDE5AMAPTKMT2APOLB
SCHEMBL401655 0.75 PDE5A (0.74) RNASEH1PDE5AMAPTKMT2AKDM4E
SCHEMBL3063800 0.73 RNASEH1 (0.52) RNASEH1PDE5AMAPTKMT2AKDM4E
SCHEMBL17888977 0.72 RNASEH1 (0.55) RNASEH1PDE5AMAPTKMT2AKDM4E
SCHEMBL3064348 0.71 SCD (0.60) RNASEH1PDE5AMAPTKMT2AKDM4E
SCHEMBL3651494 0.71 RNASEH1 (0.48) RNASEH1PDE5AMAPTTUBB4ATUBB
SCHEMBL3063830 0.71 MAPT (0.52) RNASEH1MAPTKMT2APOLB
SCHEMBL404377 0.70 RNASEH1 (0.60) RNASEH1PDE5AMAPTKMT2AKDM4E
SCHEMBL3492915 0.70 PDE5A (0.74) RNASEH1PDE5AMAPTKMT2AKDM4E

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
WO-2010045374-A1 3-HYDROQUINAZOLIN-4-ONE DERIVATIVES FOR USE AS STEAROYL COA DESATURASE INHIBITORS GILEAD PALO ALTO, INC. (US) 2010-04-22 WO disclosed