SCHEMBL8824924

SCHEMBL8824924

C=C1SC(=O)N(c2cnc3cc(CN(C)c4ccccc4)ccc3c2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ITK Q08881 2/20 0.34
IP6K1 Q92551 1/20 0.33
KDM4C Q9H3R0 2/20 0.33
PRMT5 O14744 2/20 0.33
INSR P06213 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DHFR P00374 1/20 0.31

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
SCHEMBL8824925 0.77 GAA (0.38) MEN1KMT2A
SCHEMBL6958945 0.72 CRHBP (0.42) CRHBPCRHR2MEN1KMT2AIP6K1
SCHEMBL8824956 0.71 MEN1 (0.33) MCHR1CRHBPCRHR2MEN1KMT2A
SCHEMBL8825047 0.71 GSK3A (0.48) MEN1KMT2AITKIP6K1PRMT5
SCHEMBL6958317 0.70 CRHBP (0.40) CRHBPCRHR2MEN1KMT2AITK
SCHEMBL6956099 0.69 PPARG (0.52) MEN1KMT2A
SCHEMBL6956100 0.69 PPARG (0.52) MEN1KMT2A
SCHEMBL6960807 0.68 HPGDS (0.48) CRHBPCRHR2KDM4EALDH1A1
SCHEMBL6964865 0.67 PPARG (0.49) ALDH1A1
SCHEMBL5987026 0.66 ALDH1A1 (0.45) MEN1KMT2AKDM4EALDH1A1

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-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed