SCHEMBL6659624

SCHEMBL6659624

CC(C)(C)N1CCN(CCCCN2CCN(C(C)(C)C)CCN(C(C)(C)C)CC2)CCN(C(C)(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.42
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
PAOX Q6QHF9 1/20 0.38
SIGMAR1 Q99720 1/20 0.35
KCNH2 Q12809 1/20 0.34
ALOX15 P16050 1/20 0.33

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
SCHEMBL6662182 0.97 HRH3 (0.46) HRH3GNAI3GNAO1GNAI1PAOX
SCHEMBL6658878 0.95 HRH3 (0.36) HRH3GNAI3GNAO1GNAI1PAOX
SCHEMBL21934600 0.95 HRH3 (0.36) HRH3GNAI3GNAO1GNAI1PAOX
SCHEMBL10244464 0.91 GNAO1 (0.53) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL6656278 0.89 ALOX15 (0.36) KCNH2ALOX15
SCHEMBL9611073 0.89 ALOX15 (0.36) KCNH2ALOX15
SCHEMBL20805125 0.89 HRH3 (0.34) HRH3GNAI3GNAO1GNAI1PAOX
SCHEMBL20878445 0.89 GNAO1 (0.57) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL19275138 0.89 GNAO1 (0.57) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL12677485 0.88 HRH3 (0.48) HRH3SIGMAR1

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
EP-1160267-B1 CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE JAPAN SCIENCE & TECH CORP (JP) 2004-08-04 EP disclosed
US-6689919-B1 SOLUBLE POLY(OXYFLUOROPHENYLENE) COMPOUNDS WITH EXCELLENT HEAT RESISTANCE, MEMBRANE-FORMABILITY AND CHEMICAL STABILITY JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2004-02-10 US disclosed