SCHEMBL27936610

SCHEMBL27936610

CCOC(=S)c1ccc(C)c(N)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 2/20 0.35
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAOA P21397 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.32
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 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
SCHEMBL9303460 0.77 SCN5A (0.35) ALDH1A1HSD17B10CYP3A4KMT2AMEN1
SCHEMBL27950382 0.75 POLB (0.48) POLBALDH1A1HSD17B10LMNAKMT2A
SCHEMBL5704503 0.70 LMNA (0.41) ALDH1A1LMNACYP1A2KMT2AMEN1
SCHEMBL5704543 0.70
SCHEMBL6553295 0.69 TSHR (0.50) POLBALDH1A1HSD17B10LMNAKMT2A
SCHEMBL11404233 0.69 ALDH1A1 (0.56) ALDH1A1HSD17B10LMNACYP1A2CYP3A4
Fluoride SCHEMBL28135103 0.68 TSHR (0.48) POLBALDH1A1HSD17B10LMNAKMT2A
SCHEMBL8309821 0.68 MEN1 (0.33) ALDH1A1LMNACYP1A2KMT2AMEN1
SCHEMBL272159 0.68 ALDH1A1 (0.54) ALDH1A1HSD17B10LMNACYP1A2CYP3A4
SCHEMBL1457096 0.67 KDM4E (0.48) POLBALDH1A1HSD17B10CYP1A2CYP3A4

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-103562237-B By the polymkeric substance of the carboxylicesters containing silylated amino or thiocarboxylic acid ester functional BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN disclosed
CN-103562237-A Polymers functionalized with a carboxylic or thiocarboxylic ester containing a silylated amino group BRIDGESTONE CORP 2014-02-05 CN disclosed