SCHEMBL642718

SCHEMBL642718

CCc1cccc[n+]1CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HTT P42858 2/20 0.38
POLB P06746 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
STAT3 P40763 1/20 0.38
RGS12 O14924 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
HSP90AA1 P07900 1/20 0.32
THRB P10828 1/20 0.32
MAPK1 P28482 1/20 0.32
RAD52 P43351 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL29561021 1.00 TP53 (0.40) TP53KDM4ENPC1RAB9ASMN1; SMN2
Iodide SCHEMBL31026694 0.98 KDM4E (0.42) TP53KDM4ENPC1RAB9ASMN1; SMN2
Iodide SCHEMBL9877545 0.98 KDM4E (0.42) TP53KDM4ENPC1RAB9ASMN1; SMN2
Bromide SCHEMBL15941654 0.98 NPC1 (0.41) TP53KDM4ENPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL9327099 0.98 KDM4E (0.39) TP53KDM4ENPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL30330520 0.98 KDM4E (0.39) TP53KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL30330585 0.94 KDM4E (0.40) TP53KDM4ENPC1RAB9ASMN1; SMN2
Acetic Acid SCHEMBL30212807 0.87
SCHEMBL29252174 0.87 PSIP1 (0.35) TP53KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL29252178 0.87 KDM4E (0.36) KDM4E

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 153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968918-A1 PROCESS FOR PREPARING 2,3-DIMETHYLBUT-1-ENE Institut Français du Pétrole (FR) 2008-09-17 EP claimed
WO-2007080287-A1 PROCESS FOR PREPARING 2,3-DIMETHYLBUT-1-ENE INSTITUT FRANCAIS DU PETROLE (FR) 2007-07-19 WO claimed
EP-1216024-B1 FORMULATION FOR MENOPAUSAL WOMEN DRUGTECH CORP (US) 2007-03-21 EP claimed
EP-1136123-B1 Catalytic composition and catalytic process of dimerisation, codimerisation and oligomerisation of olefins INST FRANCAIS DU PETROLE (FR) 2005-05-25 EP claimed
EP-1138388-B1 Catalytic composition for dimerisation, codimerisation and oligomerisation of olefins INST FRANCAIS DU PETROLE (FR) 2005-04-06 EP claimed
EP-1122230-B1 Process for the selective dimerisation of propylene principally to ramified dimers INST FRANCAIS DU PETROLE (FR) 2003-06-25 EP claimed
EP-1138388-A1 Catalytic composition for dimerisation, codimerisation and oligomerisation of olefins INSTITUT FRANCAIS DU PETROLE (FR) 2001-10-04 EP claimed
EP-1136123-A2 Catalytic composition and catalytic process of dimerisation, codimerisation and oligomerisation of olefins INSTITUT FRANCAIS DU PETROLE (FR) 2001-09-26 EP claimed
EP-1122230-A1 Process for the selective dimerisation of propylene principally to ramified dimers INSTITUT FRANCAIS DU PETROLE (FR) 2001-08-08 EP claimed
EP-0665057-B1 Catalytic composition and process for the disproportionation of olefins INST FRANCAIS DU PETROLE (FR) 1999-12-15 EP claimed
EP-0646412-B1 Catalyst composition and process for the dimerisation of olefins INST FRANCAIS DU PETROLE (FR) 1999-05-19 EP claimed
EP-0448445-B1 Liquid non-aqueous composition with an ionic character and its use as a solvent INST FRANCAIS DU PETROLE (FR) 1999-01-13 EP claimed
EP-0709356-B1 Catalytic composition and aliphatic hydrocarbon alkylation process INST FRANCAIS DU PETROLE (FR) 1999-01-13 EP claimed
EP-0693045-B1 ALKYLATION PROCESS BP CHEM INT LTD (GB) 1997-10-22 EP claimed
EP-0748654-A1 Aliphatic alkylation catalyst comprising an active phase containing a copper compound on a support INSTITUT FRANCAIS DU PETROLE (FR) 1996-12-18 EP claimed
EP-0709356-A1 Catalytic composition and aliphatic hydrocarbon alkylation process INSTITUT FRANCAIS DU PETROLE (FR) 1996-05-01 EP claimed
EP-0665057-A1 Catalytic composition and process for the disproportionation of olefins INSTITUT FRANCAIS DU PETROLE (FR) 1995-08-02 EP claimed
EP-0646412-A1 Catalyst composition and process for the dimerisation of olefins INSTITUT FRANCAIS DU PETROLE (FR) 1995-04-05 EP claimed
EP-0404188-B1 Non-aqueous electrolytic aluminum plating bath composition NISSHIN STEEL CO LTD (JP) 1994-03-16 EP claimed
EP-0448445-A2 Liquid non-aqueous composition with an ionic character and its use as a solvent Institut Français du Pétrole (FR) 1991-09-25 EP claimed