SCHEMBL31490171

SCHEMBL31490171

COC(=O)c1ccc2c(c1)NC(=O)NC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
LMNA P02545 2/20 0.50
PDE3B Q13370 1/20 0.49
PDE3A Q14432 1/20 0.49
ALOX5 P09917 1/20 0.45
HSD17B10 Q99714 4/20 0.43
ALOX15 P16050 3/20 0.43
CRBN Q96SW2 1/20 0.43
HTT P42858 2/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
XDH P47989 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
HPGD P15428 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL16548893 0.88 PDE3B (0.60) ALDH1A1LMNAPDE3BPDE3AALOX5
SCHEMBL15862248 0.84 ALDH1A1 (0.46) ALDH1A1LMNAALOX5HSD17B10ALOX15
SCHEMBL23781331 0.81 PDE3B (0.43) PDE3BPDE3A
SCHEMBL17957924 0.81 ALDH1A1 (0.56) ALDH1A1LMNAALOX5HSD17B10ALOX15
Hydrochloric Acid SCHEMBL17957895 0.80 ALDH1A1 (0.54) ALDH1A1LMNAALOX5HSD17B10ALOX15
SCHEMBL29374811 0.79 CRBN (0.59) ALDH1A1LMNAALOX5CRBNHTT
SCHEMBL1359221 0.79 CRBN (0.59) ALDH1A1LMNAALOX5CRBNHTT
SCHEMBL28913961 0.78 ALDH1A1 (0.45) ALDH1A1LMNAALOX5HSD17B10ALOX15
SCHEMBL29754229 0.78 CRBN (0.64) ALDH1A1LMNAALOX5HSD17B10ALOX15
SCHEMBL2497788 0.78 CRBN (0.64) ALDH1A1LMNAALOX5HSD17B10ALOX15

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
CN-115151304-B Small molecule interferon gene stimulating factor (STING) antagonists 库拉德夫制药私人有限公司 2025-02-11 CN disclosed