SCHEMBL9489668

SCHEMBL9489668

CCCCCCCCC=CC(C=CCCCCCCCC)CCCCN

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 1/20 0.54
DNM1 Q05193 8/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
EPHX1 P07099 1/20 0.48
MAPT P10636 3/20 0.45
GMNN O75496 2/20 0.45
LMNA P02545 2/20 0.45
GLA P06280 2/20 0.45
POLB P06746 2/20 0.45
THRB P10828 2/20 0.45
CETP P11597 2/20 0.45
MAPK1 P28482 2/20 0.45
CXCR5 P32302 2/20 0.45
CCR6 P51684 2/20 0.45
BLM P54132 2/20 0.45
UBE2N P61088 2/20 0.45
SPHK2 Q9NRA0 2/20 0.45

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
SCHEMBL11510655 0.94 SLC6A5 (0.48) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL11806456 0.90 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTGMNN
SCHEMBL6698177 0.90 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTGMNN
SCHEMBL7768205 0.90 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTGMNN
SCHEMBL7543859 0.81 SLC6A5 (0.52) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL10521801 0.81 SLC6A5 (0.52) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL25409164 0.80 DNM1 (0.68) SLC6A5DNM1MEN1KMT2AALDH1A1
Dectaflur SCHEMBL20875746 0.80 DNM1 (0.68) SLC6A5DNM1MEN1KMT2AALDH1A1
Dectaflur SCHEMBL21052097 0.80 DNM1 (0.68) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL22677777 0.80 DNM1 (0.68) SLC6A5DNM1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0266758-B1 PREPARATION OF SILANE AND AMINE ALANES ETHYL CORPORATION (US) 1993-01-27 EP disclosed
EP-0273229-B1 PREPARATION OF AMINE ALANES ETHYL CORPORATION (US) 1992-08-05 EP disclosed
EP-0291776-B1 STABILIZATION OF AMINE ALANES ETHYL CORPORATION (US) 1992-04-08 EP disclosed
US-4900856-A Preparation of metal halide-amine complexes ETHYL CORPORATION (US) 1990-02-13 US disclosed
US-4866191-A USING OXYGEN, CARBON MONOXIDE, NITROGEN OXIDES OR ALKYL NITRITES ETHYL CORPORATION (US) 1989-09-12 US disclosed
EP-0291776-A2 Stabilization of amine alanes ETHYL CORPORATION (US) 1988-11-23 EP disclosed
US-4782171-A WITH OXYGEN, CARBON MONOXIDE, NITROGEN OXIDE AND ALKYL NITRITES ETHYL CORPORATION (US) 1988-11-01 US disclosed
US-4757154-A Reacting alkali metal aluminum tetrahydride, silicon tetrachloride, complexing tertiary amine ETHYL CORPORATION (US) 1988-07-12 US disclosed
EP-0273229-A2 Preparation of amine alanes ETHYL CORPORATION (US) 1988-07-06 EP disclosed
US-4748260-A Preparation of amine alanes ETHYL CORPORATION (US) 1988-05-31 US disclosed
EP-0266758-A2 Preparation of silane and amine alanes ETHYL CORPORATION (US) 1988-05-11 EP disclosed
US-4730070-A PASSIVATION OF TITANIUM CATALYST ETHYL CORPORATION (US) 1988-03-08 US disclosed