SCHEMBL8052292

SCHEMBL8052292

c1ccc(-c2csc(Sc3nnc(-c4cc5ccccc5s4)n3-c3ccccc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 1/20 0.46
TSHR P16473 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CYP19A1 P11511 1/20 0.37
HTT P42858 3/20 0.36
RAB9A P51151 2/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
USP2 O75604 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
HTR7 P34969 1/20 0.35
HPGD P15428 1/20 0.35
MAPT P10636 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
SCHEMBL8042745 0.93 RPA1 (0.47) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8044765 0.89 RPA1 (0.41) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8042687 0.87 RPA1 (0.48) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8046211 0.84 RPA1 (0.48) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8049124 0.82 TSHR (0.60) TSHRKDM4EHSD17B10ALDH1A1MAPK1
SCHEMBL8044879 0.82 RPA1 (0.47) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8042821 0.81 RPA1 (0.54) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8033921 0.80 RPA1 (0.47) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8049440 0.79 RPA1 (0.51) RPA1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL8032636 0.78 ATM (0.47) TSHRALDH1A1MAPK1HDAC6HTT

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