SCHEMBL28390983

SCHEMBL28390983

CCCCCCCCCCCCCCCCSc1cccs1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.43
SOAT1 P35610 9/20 0.40
PTGS2 P35354 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
STAT6 P42226 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
HIF1A Q16665 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL27916875 1.00 FBP1 (0.43) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL5315566 1.00 FBP1 (0.43) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL20669518 1.00 FBP1 (0.43) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL17372958 1.00 FBP1 (0.43) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL9724074 0.98 FBP1 (0.45) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL425181 0.92 FBP1 (0.46) FBP1SOAT1PTGS2HDAC1HDAC11
SCHEMBL10365892 0.84
Ammonia Solution, Strong SCHEMBL7247507 0.82 FBP1 (0.48) FBP1SOAT1PTGS2ALDH1A1KDM4E
SCHEMBL6277977 0.81 CA2 (0.44) FBP1ALDH1A1MAPTHPGDHTT
SCHEMBL6281075 0.81 FBP1 (0.43) FBP1PTGS2ALDH1A1MAPTHPGD

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-111116873-B Bipolar semiconductor polymer based on F atom regulation and preparation method and application thereof 杭州泰虹科技有限公司 2022-05-20 CN disclosed
CN-111116873-A Bipolar semiconductor polymer based on F atom regulation and preparation method and application thereof 杭州泰虹科技有限公司 2020-05-08 CN disclosed