SCHEMBL18330670

SCHEMBL18330670

CCC(C)(C)c1ccc(OCCOCCOc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.49
MAOB P27338 11/20 0.49
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL14934602 0.83 HRH3 (0.52) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL10030387 0.82 NPC1 (0.69) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL11050500 0.82 RXRA (0.55) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL3630819 0.82 NPC1 (0.50) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL15275326 0.80 L3MBTL1 (0.49) MAOBALDH1A1
SCHEMBL13484319 0.80 HRH3 (0.52) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL4053418 0.79 MEN1 (0.50) MAOB
SCHEMBL19509695 0.79 HRH3 (0.58) HRH3MAOBNPC1MAPTRAB9A
SCHEMBL10824702 0.78 KMT2A (0.59) MAOBNPC1RAB9A
SCHEMBL13857064 0.77 HRH3 (0.57) HRH3MAOBNPC1MAPTRAB9A

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-20160372667-A1 LIGHT EMITTING COMPOSITION AND DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2016-12-22 US disclosed