SCHEMBL8050696

SCHEMBL8050696

S=C1N=NC(c2cc(Cl)cc(Cl)c2)=N1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
GFER P55789 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TSHR P16473 1/20 0.35

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
SCHEMBL8044653 0.74 BACE1 (0.35)
SCHEMBL8043935 0.69 RXRA (0.33)
SCHEMBL8044128 0.68
SCHEMBL8042073 0.67 MAPT (0.43)
SCHEMBL8033667 0.64
SCHEMBL8034315 0.64 MMP12 (0.32)
SCHEMBL578021 0.64 TSHR (0.38) ALDH1A1GFERRXFP1TSHR
SCHEMBL463754 0.63 TSHR (0.73) ALDH1A1GFERRXFP1TSHR
SCHEMBL8043101 0.63
SCHEMBL8045800 0.62 DAO (0.33)

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