SCHEMBL9399130

SCHEMBL9399130

COC(=O)CSc1cccc(-c2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 3/20 0.52
RXFP1 Q9HBX9 3/20 0.52
ALOX15 P16050 2/20 0.52
MAPK1 P28482 2/20 0.52
HTR1A P08908 1/20 0.52
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52
HTR7 P34969 1/20 0.52
PRNP P04156 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
KDM4E B2RXH2 1/20 0.52
GAA P10253 1/20 0.51
NPSR1 Q6W5P4 3/20 0.48
USP2 O75604 2/20 0.48
TSHR P16473 2/20 0.48
POLB P06746 2/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL9399514 0.78 HSD17B10 (0.53) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL2297589 0.75 HTR7 (0.64) HSD17B10ALDH1A1HPGDMAPK1HTR1A
SCHEMBL13199784 0.75 MIF (0.48) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL13217511 0.74 ALDH1A1 (0.49) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL13199783 0.74 HSD17B10 (0.49) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL3759901 0.74 LMNA (0.72) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL14444304 0.73 L3MBTL1 (0.52) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL28946877 0.72 HTR1A (0.54) HSD17B10ALDH1A1HPGDRXFP1ALOX15
SCHEMBL15058041 0.71 CNR2 (0.46) ALDH1A1HPGDKDM4ENPSR1LMNA
Methane SCHEMBL29187642 0.71 HTR1A (0.53) HSD17B10ALDH1A1HPGDRXFP1ALOX15

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
US-5310919-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5120734-A FUNGICIDAL PYRID-2-YL-AMINO ACETIC ACID ESTERS BAYER AKTIENGESELLSCHAFT (DE) 1992-06-09 US disclosed
US-5008275-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1991-04-16 US disclosed