SCHEMBL8033860

SCHEMBL8033860

CN(C)CCCn1nnnc1Sc1nc(C(C)(C)C)c(Br)s1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DCUN1D1 Q96GG9 20/20 0.36
UBE2M P61081 19/20 0.36
KDM1A O60341 1/20 0.34

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
SCHEMBL8032337 0.87 HTT (0.39)
SCHEMBL8042403 0.86 DCUN1D1 (0.38) DCUN1D1UBE2MKDM1A
SCHEMBL8052246 0.85 KMT2A (0.36)
SCHEMBL8044008 0.84 ALDH1A1 (0.42)
SCHEMBL8045327 0.82 ALDH1A1 (0.42)
SCHEMBL8047183 0.81
SCHEMBL8032728 0.78 ALDH1A1 (0.37) DCUN1D1UBE2M
SCHEMBL8047970 0.78 HTT (0.39)
SCHEMBL8046340 0.77 KMT2A (0.34)
SCHEMBL8043236 0.77 UBE2M (0.35) DCUN1D1UBE2MKDM1A

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
US-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed