SCHEMBL14136137

SCHEMBL14136137

OCCCn1c(=S)sc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.52
SLC6A4 P31645 1/20 0.52
SLC6A3 Q01959 1/20 0.52
CYP1A2 P05177 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL6547890 0.90 ALDH1A1 (0.49) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1
SCHEMBL8030664 0.83 DRD2 (0.52) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1
SCHEMBL8079249 0.82 ALDH1A1 (0.51) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1
SCHEMBL11064413 0.81 F12 (0.53) CYP1A2ALDH1A1HSD17B10L3MBTL1NPC1
SCHEMBL6741877 0.81 DRD2 (0.53) DRD2SLC6A4SLC6A3
SCHEMBL11776240 0.81 DRD2 (0.53) DRD2SLC6A4SLC6A3
SCHEMBL4230610 0.80 L3MBTL1 (0.65) CYP1A2L3MBTL1NPC1CYP3A4CYP2D6
SCHEMBL11782096 0.79 DRD2 (0.48) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1
SCHEMBL11082445 0.78 HTT (0.70) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1
SCHEMBL11079506 0.76 KDM4E (0.55) DRD2SLC6A4SLC6A3CYP1A2ALDH1A1

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-7396638-B2 Photothermographic material and image forming method FUJIFILM CORPORATION (JP) 2008-07-08 US disclosed