SCHEMBL3668720

SCHEMBL3668720

CCCCc1c(S)cccc1CCN

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 0.44
HTR2A P28223 3/20 0.38
HTR1A P08908 1/20 0.36
TLR8 Q9NR97 4/20 0.35
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL3670351 0.92 TLR8 (0.43) TAAR1HTR2ATLR8
SCHEMBL3671144 0.89 TAAR1 (0.42) TAAR1HTR2AMAPTSMN1; SMN2NPSR1
SCHEMBL8517572 0.89 LIPG (0.39) NPSR1
SCHEMBL3769573 0.84 LIPG (0.46)
SCHEMBL15105218 0.84 IAPP (0.39) TAAR1HTR1A
SCHEMBL8517004 0.82 LIPG (0.49)
SCHEMBL8517066 0.82 LIPG (0.49)
SCHEMBL8517192 0.82 LIPG (0.49)
SCHEMBL8517160 0.82 LIPG (0.49)
SCHEMBL8518028 0.82 LIPG (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426392-B1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2010-02-24 EP disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed