SCHEMBL23185482

SCHEMBL23185482

CC(S)C(C)c1cccc(OC(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.35
▸ KIF11 P52732 1/20 0.35
▸ ACHE P22303 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ SLC6A4 P31645 1/20 0.32
▸ CASR P41180 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CETP P11597 1/20 0.31
▸ BCHE P06276 2/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ AOC3 Q16853 1/20 0.30
▸ FAAH O00519 1/20 0.30
▸ ACACB O00763 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
SCHEMBL13119204 0.82 KDM4E (0.46) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL6055102 0.81 AOC3 (0.40) PTGS1KIF11ACHESLC6A4MEN1
SCHEMBL18356000 0.80 PTGS1 (0.38) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL2030537 0.79 SLC6A2 (0.41) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL2031161 0.79 SLC6A2 (0.41) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL8045780 0.79 PTGS1 (0.40) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL6055145 0.79 UGT2B7 (0.44) PTGS1KIF11ACHEMEN1CYP2D6
SCHEMBL2031297 0.79 SLC6A2 (0.41) PTGS1KIF11ACHEKDM4ETSHR
SCHEMBL18287934 0.77 AOC3 (0.39) PTGS1KIF11CETPALOX5AOC3
SCHEMBL10148454 0.76 HDAC4 (0.46) PTGS1KIF11ACHEKDM4ETSHR

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
US-10969685-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-04-06 — — US disclosed
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