SCHEMBL18247351

SCHEMBL18247351

NC(=S)n1cc(-c2ccnc3ccccc23)cn1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 12/20 0.58
▸ KCNH2 Q12809 2/20 0.58
▸ HTR2B P41595 1/20 0.58
▸ MTNR1A P48039 1/20 0.58
▸ BMP4 P12644 3/20 0.44
▸ CYP1A2 P05177 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ TTK P33981 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ INCENP Q9NQS7 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ GRM2 Q14416 1/20 0.40
▸ TGFBR1 P36897 1/20 0.40
▸ MAPK14 Q16539 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
SCHEMBL31428975 0.76 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1ABMP4
SCHEMBL355762 0.76 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1ABMP4
SCHEMBL28863738 0.75 TGFBR1 (0.51) GRM4KCNH2HTR2BMTNR1ABMP4
SCHEMBL15942032 0.73 GRM4 (1.00) GRM4KCNH2HTR2BMTNR1A
SCHEMBL28199101 0.73 GRM4 (0.85) GRM4KCNH2HTR2BMTNR1AGRM2
SCHEMBL7859091 0.69 GRM4 (1.00) GRM4KCNH2HTR2BMTNR1A
SCHEMBL35327 0.69 TGFBR1 (0.60) GRM4KCNH2HTR2BMTNR1ABMP4
SCHEMBL30439957 0.69 TGFBR1 (0.60) GRM4KCNH2HTR2BMTNR1ABMP4
SCHEMBL2710540 0.69 GRM4 (0.77) GRM4KCNH2HTR2BMTNR1AGRM2
SCHEMBL28019346 0.68 TGFBR1 (0.60) GRM4KCNH2HTR2BMTNR1ABMP4

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-109996870-A Midbrain specificity organoid is generated from human pluripotent stem cells 新加坡科技研究局 2019-07-09 — — CN disclosed
WO-2016187135-A1 EPIDERMAL NEURAL CREST STEM CELLS AS A SOURCE OF SCHWANN CELLS SIEBER-BLUM MAYA (US) 2016-11-24 — — WO disclosed
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