SCHEMBL990725

SCHEMBL990725

CCN(CC)CC.S=P1(S)Oc2ccccc2-c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD1 P21728 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
ADRA1A P35348 1/20 0.30
OPRM1 P35372 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL930294 0.87 KDM4E (0.34)
SCHEMBL931567 0.82 CHRM2 (0.30) CHRM2HTR1AADRA2ACHRM1DRD1
SCHEMBL11336478 0.71 KDM4E (0.31)
SCHEMBL14953706 0.68
SCHEMBL26745090 0.67 KDM4E (0.32)
SCHEMBL931274 0.66 KDM4E (0.31)
SCHEMBL930972 0.66 KDM4E (0.31)
SCHEMBL13278167 0.66 KDM4E (0.34)
SCHEMBL23331387 0.66
SCHEMBL29612194 0.66 ALDH1A1 (0.33)

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
US-20120184635-A1 Flameproof expandable polymerizates Sunpor Kunststoff Ges m.b.H. (AT) 2012-07-19 US disclosed
CN-102597091-A Flame retardant expandable polymers SUNPOR KUNSTSTOFF GMBH 2012-07-18 CN disclosed
EP-2449018-A1 FLAME-RETARDANT EXPANDABLE POLYMERS Sunpor Kunststoff GmbH (AT) 2012-05-09 EP disclosed
WO-2011000018-A1 FLAME-RETARDANT EXPANDABLE POLYMERS SUNPOR KUNSTSTOFF GES.M.B.H. (AT) 2011-01-06 WO disclosed