SCHEMBL2364670

SCHEMBL2364670

C=CC(CCCC)N(C(C=C)CCCC)C(C=C)CCCC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
ALDH1A1 P00352 4/20 0.36
DNM1 Q05193 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
BDKRB2 P30411 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.30
FDPS P14324 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
SCHEMBL8733682 0.78 TSHR (0.39) TSHRALDH1A1DNM1SMN1; SMN2CYP3A4
SCHEMBL21771359 0.76 ALDH1A1 (0.30) TSHRALDH1A1
SCHEMBL14660213 0.75 TSHR (0.50) TSHRALDH1A1DNM1SMN1; SMN2BDKRB2
SCHEMBL28146531 0.75 TSHR (0.39) TSHRDNM1
SCHEMBL27521083 0.75 TSHR (0.39) TSHRDNM1
SCHEMBL28051178 0.75 TSHR (0.39) TSHRDNM1
SCHEMBL27585313 0.75 TSHR (0.39) TSHRDNM1
SCHEMBL5178163 0.74 TSHR (0.38) TSHRSMN1; SMN2FDPS
SCHEMBL8751663 0.74 CA2 (0.39) TSHR
SCHEMBL24322546 0.73 PLA2G1B (0.34) TSHRALDH1A1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325096-A1 TRIS(ENYLARYL)AMINE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-31 US claimed
US-20090325095-A1 TRIS AND BIS(ENYLARYL)ARYLAMINE MIXTURES CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-31 US claimed
US-8007971-B2 Tris(enylaryl)amine containing photoconductors XEROX CORPORATION (US) 2011-08-30 US disclosed
US-7981580-B2 Tris and bis(enylaryl)arylamine mixtures containing photoconductors XEROX CORPORATION (US) 2011-07-19 US disclosed
EP-2141546-A1 Photoconductors containing Tris and Bis(enylaryl)arylamine Xerox Corporation (US) 2010-01-06 EP disclosed
US-20090325096-A1 TRIS(ENYLARYL)AMINE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-31 US disclosed
US-20090325095-A1 TRIS AND BIS(ENYLARYL)ARYLAMINE MIXTURES CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-31 US disclosed