SCHEMBL29757192

SCHEMBL29757192

Cc1ccc(C(N)=S)cc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.61
PRSS2 P07478 1/20 0.61
PRSS3 P35030 1/20 0.61
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 2/20 0.44
NPC1 O15118 1/20 0.44
MITF O75030 1/20 0.44
GFER P55789 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP1A2 P05177 1/20 0.41
PRKCI P41743 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL11063883 1.00 PRSS1 (0.61) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL13495684 0.82 TDP1 (0.61) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL7399384 0.80 CHRNA1 (0.42) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL1459704 0.80 HPGD (0.47) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL8262228 0.80 MTOR (0.42) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL9548006 0.78 PRSS1 (0.52) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL12824890 0.78 PRSS1 (0.64) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL11405390 0.78 PRSS1 (0.52) PRSS1PRSS2PRSS3HTTSMN1; SMN2
SCHEMBL15947332 0.77 ALOX15 (0.60) HTTSMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL1063944 0.77 ALDH1A1 (0.46) CES2CES1ALDH1A1LMNAKMT2A

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-112695549-B Low-temperature soaping agent for reactive dye printing and preparation method thereof 浙江震东新材料有限公司 2022-07-29 CN claimed
CN-112695549-B Low-temperature soaping agent for reactive dye printing and preparation method thereof 浙江震东新材料有限公司 2022-07-29 CN disclosed