SCHEMBL28802249

SCHEMBL28802249

CCCCCCCCC(CCCCCC)Cc1ccsc1[SnH]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33
▸ CSNK1E P49674 1/20 0.32
▸ TP53 P04637 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ G6PD P11413 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ GPR35 Q9HC97 1/20 0.31
▸ LTB4R Q15722 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
SCHEMBL28872855 0.82 LMNA (0.37) LMNATSHRGLAHTTL3MBTL1
SCHEMBL19765272 0.81 LMNA (0.36) LMNATSHRGLAHTTL3MBTL1
SCHEMBL2564843 0.81 LMNA (0.36) LMNATSHRGLAHTTL3MBTL1
SCHEMBL1436564 0.81 LMNA (0.36) LMNATSHRGLAHTTL3MBTL1
SCHEMBL15401019 0.80 GLA (0.34) LMNATSHRGLAHTTL3MBTL1
SCHEMBL28895929 0.79 GLA (0.35) LMNATSHRGLAHTTL3MBTL1
SCHEMBL28431769 0.79 GLA (0.36) LMNATSHRGLAHTTL3MBTL1
SCHEMBL19917286 0.76 SLC6A4 (0.33) LMNATSHRGLAHTTL3MBTL1
SCHEMBL366507 0.75 TYR (0.38) TSHRHTTTP53ALDH1A1HSP90AA1
SCHEMBL20680900 0.75 TSHR (0.38) LMNATSHRGLAHTTL3MBTL1

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-102844312-B Polymers of benzodithiophene and their use as organic semiconductors MERCK PATENT GMBH 2015-04-15 — — CN disclosed
CN-102844312-A Polymers of benzodithiophene and their use as organic semiconductors MERCK PATENT GMBH 2012-12-26 — — CN disclosed
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