SCHEMBL31047644

SCHEMBL31047644

Fc1c(F)c(F)c2c(c1F)Sc1cccc(-c3ccccc3)c1S2

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 2/20 0.32
HPGD P15428 1/20 0.32
BCL2L1 Q07817 1/20 0.32
CYP2A6 P11509 1/20 0.32
MAPK1 P28482 1/20 0.32
ERBB2 P04626 1/20 0.32
ERBB4 Q15303 1/20 0.32
METAP2 P50579 1/20 0.32
GPR84 Q9NQS5 2/20 0.31
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30
KAT6A Q92794 1/20 0.30
HNF4A P41235 1/20 0.30

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
SCHEMBL16634418 0.87 ALOX5 (0.47) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL20426089 0.85 ALOX5 (0.47) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL16869965 0.85 ALOX5 (0.46) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL10985315 0.83 ALOX5 (0.53) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL16165379 0.79 ALOX5 (0.50) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL18267880 0.79 MEN1 (0.43) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL18267881 0.76 MEN1 (0.41) ALOX5MEN1KMT2AALDH1A1HSD17B10
SCHEMBL15683855 0.76 ALDH1A1 (0.42) ALOX5ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL21924392 0.76 NOX1 (0.35) ALOX5MEN1KMT2A
SCHEMBL15617266 0.75 ALDH1A1 (0.50) ALOX5ALDH1A1HSD17B10HPGDBCL2L1

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-118496051-A Novel method for synthesizing trans-1, 2-stilbene 内蒙古大学 2024-08-16 CN disclosed