SCHEMBL28307436

SCHEMBL28307436

CS(=O)(=O)c1nc(-c2ccccc2)cc(C(F)(F)F)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 10/20 1.00
SDHB P21912 9/20 1.00
HPGD P15428 9/20 1.00
LMNA P02545 7/20 1.00
TP53 P04637 7/20 1.00
STAT3 P40763 6/20 1.00
KMT2A Q03164 6/20 1.00
HTT P42858 6/20 1.00
HSD17B10 Q99714 6/20 1.00
RAB9A P51151 5/20 1.00
STAT1 P42224 4/20 1.00
TLR9 Q9NR96 4/20 1.00
S1PR4 O95977 4/20 1.00
S1PR1 P21453 4/20 1.00
MAPK1 P28482 4/20 1.00
MEN1 O00255 1/20 1.00
POLB P06746 1/20 1.00
SMN1; SMN2 Q16637 7/20 0.76
KDM4E B2RXH2 5/20 0.76
ALDH1A1 P00352 4/20 0.76

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
SCHEMBL29975914 1.00 NPSR1 (1.00) NPSR1SDHBHPGDLMNATP53
SCHEMBL4721292 0.88 SDHB (0.81) NPSR1SDHBHPGDLMNATP53
SCHEMBL19805665 0.87 NPSR1 (1.00) NPSR1SDHBHPGDLMNATP53
SCHEMBL19805673 0.87 SDHB (1.00) NPSR1SDHBHPGDLMNATP53
SCHEMBL19805645 0.86 SDHB (1.00) NPSR1SDHBHPGDLMNATP53
SCHEMBL28307444 0.86 SDHB (0.75) NPSR1SDHBHPGDLMNATP53
SCHEMBL29975679 0.86 SDHB (0.76) NPSR1SDHBHPGDLMNATP53
SCHEMBL19805664 0.86 SDHB (0.76) NPSR1SDHBHPGDLMNATP53
SCHEMBL3569045 0.86 SDHB (0.76) NPSR1SDHBHPGDLMNATP53
SCHEMBL19805674 0.86 SDHB (1.00) NPSR1SDHBHPGDLMNATP53

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
CN-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 CN disclosed
CN-110023292-A Apoptosis inhibitor 北京生命科学研究所 2019-07-16 CN disclosed