SCHEMBL8083706

SCHEMBL8083706

COc1ccc(-c2csc(C)n2)cc1N

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
RECQL P46063 3/20 0.65
GAA P10253 2/20 0.65
GFER P55789 1/20 0.65
ALDH1A1 P00352 7/20 0.57
NPC1 O15118 6/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
RAB9A P51151 5/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TSHR P16473 1/20 0.55
POLB P06746 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 1/20 0.53
ESR2 Q92731 1/20 0.53
HSD17B10 Q99714 1/20 0.48
ECE1 P42892 1/20 0.47
ROCK2 O75116 1/20 0.47
PIM1 P11309 1/20 0.47
GSK3B P49841 1/20 0.47

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
SCHEMBL25288808 0.88 RAB9A (0.73) MAPTRECQLGAAGFERALDH1A1
SCHEMBL31084666 0.88 RAB9A (0.73) MAPTRECQLGAAGFERALDH1A1
SCHEMBL6040790 0.86 MAPT (0.75) MAPTRECQLGAAGFERALDH1A1
SCHEMBL19626555 0.82 MAPT (0.69) MAPTRECQLGAAGFERALDH1A1
SCHEMBL13367649 0.82 ALDH1A1 (0.74) MAPTRECQLGAAGFERALDH1A1
SCHEMBL8081684 0.81 MAPT (0.64) MAPTRECQLGAAGFERALDH1A1
SCHEMBL3346281 0.81 RECQL (0.61) MAPTRECQLGAAGFERALDH1A1
SCHEMBL7811998 0.78 MAPT (0.64) MAPTRECQLGAAGFERALDH1A1
SCHEMBL12021849 0.78 RECQL (0.58) MAPTRECQLGAAGFERALDH1A1
SCHEMBL4094288 0.78 RECQL (0.58) MAPTRECQLGAAGFERALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0836596-B1 HYDRAZINE DERIVATIVES UNIROYAL CHEM CO INC (US) 2000-08-23 EP disclosed
EP-0836596-A1 HYDRAZINE DERIVATIVES UNIROYAL CHEMICAL COMPANY, Inc. (US) 1998-04-22 EP disclosed
WO-1997002257-A1 HYDRAZINE DERIVATIVES UNIROYAL CHEMICAL COMPANY, INC. (US) 1997-01-23 WO disclosed