SCHEMBL8043642

SCHEMBL8043642

COc1ccc(O)c(-c2nnc(Sc3nc4ccccc4s3)n2-c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
KMT2A Q03164 6/20 0.52
KDM4E B2RXH2 5/20 0.52
MEN1 O00255 4/20 0.52
JAK2 O60674 1/20 0.52
ATM Q13315 1/20 0.52
ALDH1A1 P00352 7/20 0.46
LMNA P02545 5/20 0.46
HPGD P15428 3/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
PTGS2 P35354 1/20 0.43
HTT P42858 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
NPSR1 Q6W5P4 3/20 0.43
ALPG P10696 1/20 0.42
CDC25A P30304 1/20 0.42
CDC25B P30305 1/20 0.42
USP2 O75604 1/20 0.41
MT-CO2 P00403 1/20 0.40

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
SCHEMBL8042199 0.89 ALPG (0.46) MAPTKMT2AKDM4EMEN1JAK2
SCHEMBL8050309 0.87 ALDH1A1 (0.44) MAPTKMT2AKDM4EMEN1JAK2
SCHEMBL8045447 0.86 POLA1 (0.41) MAPTKMT2AKDM4EMEN1JAK2
SCHEMBL8033875 0.86 MAPT (0.45) MAPTKMT2AKDM4EMEN1JAK2
SCHEMBL8033784 0.85 ALPG (0.42) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8033695 0.83 ALPG (0.44) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8044539 0.83 ALPG (0.44) MAPTKMT2AKDM4EMEN1ATM
SCHEMBL8033699 0.82 KMT2A (0.55) MAPTKMT2AKDM4EMEN1JAK2
SCHEMBL8042393 0.81 ALPG (0.40) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL8032437 0.81 ALPG (0.42) MAPTKMT2AKDM4EMEN1ALDH1A1

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-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed