SCHEMBL21189696

SCHEMBL21189696

CC(C)CC(C)(c1ccccc1S)c1ccccc1S

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RIPK1 Q13546 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
SCHEMBL21189695 0.79
SCHEMBL5503676 0.78 ALDH1A1 (0.54) ALDH1A1TSHRTDP1GAASMN1; SMN2
SCHEMBL21189685 0.73 AAK1 (0.37)
SCHEMBL9396200 0.72 ALDH1A1 (0.39) ALDH1A1TSHRTDP1
SCHEMBL30772132 0.72 ALDH1A1 (0.50) ALDH1A1TSHRTDP1GAASMN1; SMN2
SCHEMBL732202 0.72 ALDH1A1 (0.50) ALDH1A1TSHRTDP1GAASMN1; SMN2
SCHEMBL6277129 0.71 TAAR1 (0.43) ALDH1A1GAASMN1; SMN2RIPK1
SCHEMBL10604983 0.71 CA2 (0.63) ALDH1A1TSHRTDP1GAASMN1; SMN2
SCHEMBL22367879 0.70 ALDH1A1 (0.48) ALDH1A1TSHRTDP1GAASMN1; SMN2
SCHEMBL6256646 0.70 ALDH1A1 (0.48) ALDH1A1TSHRTDP1GAASMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210047457-A1 COMPOUND, RESIN, COMPOSITION AND PATTERN FORMATION METHOD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-02-18 US disclosed
EP-3744710-A1 COMPOUND, RESIN, COMPOSITION, AND PATTERN FORMING METHOD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-12-02 EP disclosed
WO-2019142897-A1 COMPOUND, RESIN, COMPOSITION, AND PATTERN FORMING METHOD 三菱瓦斯化学株式会社 2019-07-25 WO disclosed